(5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
type: datablock
datablock name: L4N
has chem comp category: chem compCategory
has chem comp atom category: chem comp atomCategory
has chem comp bond category: chem comp bondCategory
has pdbx chem comp audit category: pdbx chem comp auditCategory
has pdbx chem comp descriptor category: pdbx chem comp descriptorCategory
has pdbx chem comp identifier category: pdbx chem comp identifierCategory

L4N
type: chem comp
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
chem comp.id: L4N
chem comp.formula: C14 H18 N2 O
chem comp.formula weight: 230.306
chem comp.name: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
chem comp.pdbx ambiguous flag: N
chem comp.pdbx formal charge: 0
chem comp.pdbx ideal coordinates details: Corina
chem comp.pdbx ideal coordinates missing flag: N
chem comp.pdbx initial date: 2023-08-15
chem comp.pdbx model coordinates db code: 7GC0
chem comp.pdbx model coordinates missing flag: N
chem comp.pdbx modified date: 2023-11-03
chem comp.pdbx processing site: RCSB
chem comp.pdbx release status: REL
chem comp.pdbx type: HETAIN
chem comp.three letter code: L4N
chem comp.type: non-polymer

N1,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N1
chem comp atom.comp id: L4N
chem comp atom.alt atom id: N1
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.883
chem comp atom.model cartn y: -0.566
chem comp atom.model cartn z: 20.967
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: N1
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 0.895
chem comp atom.pdbx model cartn y ideal: 0.730
chem comp atom.pdbx model cartn z ideal: -0.082
chem comp atom.pdbx ordinal: 1
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

C4,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C4
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C1
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.359
chem comp atom.model cartn y: -0.122
chem comp atom.model cartn z: 18.614
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C4
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 2.231
chem comp atom.pdbx model cartn y ideal: -1.249
chem comp atom.pdbx model cartn z ideal: 0.313
chem comp atom.pdbx ordinal: 2
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C5,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C5
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C2
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.007
chem comp atom.model cartn y: -0.097
chem comp atom.model cartn z: 19.965
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C5
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 2.143
chem comp atom.pdbx model cartn y ideal: 0.112
chem comp atom.pdbx model cartn z ideal: 0.049
chem comp atom.pdbx ordinal: 3
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C6,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C6
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C3
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.061
chem comp atom.model cartn y: 0.014
chem comp atom.model cartn z: 21.267
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C6
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -0.181
chem comp atom.pdbx model cartn y ideal: 0.006
chem comp atom.pdbx model cartn z ideal: -0.449
chem comp atom.pdbx ordinal: 4
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C7,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C7
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C4
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.805
chem comp atom.model cartn y: -0.644
chem comp atom.model cartn z: 22.396
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C7
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.547
chem comp atom.pdbx model cartn y ideal: 0.642
chem comp atom.pdbx model cartn z ideal: -0.467
chem comp atom.pdbx ordinal: 5
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C

C8,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C8
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C5
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.511
chem comp atom.model cartn y: 0.369
chem comp atom.model cartn z: 23.319
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C8
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.941
chem comp atom.pdbx model cartn y ideal: 1.120
chem comp atom.pdbx model cartn z ideal: 0.954
chem comp atom.pdbx ordinal: 6
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C10,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C10
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C6
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.192
chem comp atom.model cartn y: -0.958
chem comp atom.model cartn z: 22.154
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C10
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -3.853
chem comp atom.pdbx model cartn y ideal: -0.074
chem comp atom.pdbx model cartn z ideal: 0.032
chem comp atom.pdbx ordinal: 7
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C13,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C13
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C7
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.841
chem comp atom.model cartn y: -1.661
chem comp atom.model cartn z: 21.907
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C13
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -2.625
chem comp atom.pdbx model cartn y ideal: -0.403
chem comp atom.pdbx model cartn z ideal: -0.828
chem comp atom.pdbx ordinal: 8
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

O,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: O
chem comp atom.comp id: L4N
chem comp atom.alt atom id: O1
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.507
chem comp atom.model cartn y: 0.996
chem comp atom.model cartn z: 20.675
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: O
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -0.049
chem comp atom.pdbx model cartn y ideal: -1.157
chem comp atom.pdbx model cartn z ideal: -0.766
chem comp atom.pdbx ordinal: 9
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O

C12,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C12
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C8
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.299
chem comp atom.model cartn y: -1.097
chem comp atom.model cartn z: 21.162
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C12
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -4.742
chem comp atom.pdbx model cartn y ideal: -1.181
chem comp atom.pdbx model cartn z ideal: 0.590
chem comp atom.pdbx ordinal: 10
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C11,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C11
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C9
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.401
chem comp atom.model cartn y: -1.759
chem comp atom.model cartn z: 22.511
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C11
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -5.266
chem comp atom.pdbx model cartn y ideal: -0.256
chem comp atom.pdbx model cartn z ideal: -0.511
chem comp atom.pdbx ordinal: 11
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C9,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C9
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C10
chem comp atom.charge: 0
chem comp atom.model cartn x: 12.971
chem comp atom.model cartn y: 0.414
chem comp atom.model cartn z: 22.836
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C9
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -3.489
chem comp atom.pdbx model cartn y ideal: 1.151
chem comp atom.pdbx model cartn z ideal: 0.889
chem comp atom.pdbx ordinal: 12
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C1,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C1
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C11
chem comp atom.charge: 0
chem comp atom.model cartn x: 6.767
chem comp atom.model cartn y: 0.454
chem comp atom.model cartn z: 20.334
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C1
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 3.316
chem comp atom.pdbx model cartn y ideal: 0.851
chem comp atom.pdbx model cartn z ideal: -0.085
chem comp atom.pdbx ordinal: 13
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C12
chem comp atom.charge: 0
chem comp atom.model cartn x: 6.344
chem comp atom.model cartn y: 0.580
chem comp atom.model cartn z: 21.777
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: C
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 3.268
chem comp atom.pdbx model cartn y ideal: 2.330
chem comp atom.pdbx model cartn z ideal: -0.371
chem comp atom.pdbx ordinal: 14
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

N,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: N
chem comp atom.comp id: L4N
chem comp atom.alt atom id: N2
chem comp atom.charge: 0
chem comp atom.model cartn x: 7.575
chem comp atom.model cartn y: 0.361
chem comp atom.model cartn z: 17.642
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: N
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 3.405
chem comp atom.pdbx model cartn y ideal: -1.834
chem comp atom.pdbx model cartn z ideal: 0.442
chem comp atom.pdbx ordinal: 15
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N

C3,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C3
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C13
chem comp atom.charge: 0
chem comp atom.model cartn x: 6.395
chem comp atom.model cartn y: 0.879
chem comp atom.model cartn z: 18.005
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C3
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.534
chem comp atom.pdbx model cartn y ideal: -1.161
chem comp atom.pdbx model cartn z ideal: 0.326
chem comp atom.pdbx ordinal: 16
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

C2,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: C2
chem comp atom.comp id: L4N
chem comp atom.alt atom id: C14
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.957
chem comp atom.model cartn y: 0.940
chem comp atom.model cartn z: 19.314
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: Y
chem comp atom.pdbx component atom id: C2
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.528
chem comp atom.pdbx model cartn y ideal: 0.194
chem comp atom.pdbx model cartn z ideal: 0.053
chem comp atom.pdbx ordinal: 17
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C

H1,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H1
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H1
chem comp atom.charge: 0
chem comp atom.model cartn x: 8.613
chem comp atom.model cartn y: -1.377
chem comp atom.model cartn z: 21.485
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H1
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 0.803
chem comp atom.pdbx model cartn y ideal: 1.679
chem comp atom.pdbx model cartn z ideal: 0.096
chem comp atom.pdbx ordinal: 18
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H2,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H2
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H2
chem comp atom.charge: 0
chem comp atom.model cartn x: 9.311
chem comp atom.model cartn y: -0.552
chem comp atom.model cartn z: 18.339
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H2
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 1.329
chem comp atom.pdbx model cartn y ideal: -1.832
chem comp atom.pdbx model cartn z ideal: 0.419
chem comp atom.pdbx ordinal: 19
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H3,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H3
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H3
chem comp atom.charge: 0
chem comp atom.model cartn x: 10.072
chem comp atom.model cartn y: -1.189
chem comp atom.model cartn z: 23.008
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H3
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.570
chem comp atom.pdbx model cartn y ideal: 1.475
chem comp atom.pdbx model cartn z ideal: -1.169
chem comp atom.pdbx ordinal: 20
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H4,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H4
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H4
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.045
chem comp atom.model cartn y: 1.361
chem comp atom.model cartn z: 23.229
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H4
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.600
chem comp atom.pdbx model cartn y ideal: 0.410
chem comp atom.pdbx model cartn z ideal: 1.708
chem comp atom.pdbx ordinal: 21
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H5,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H5
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H5
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.462
chem comp atom.model cartn y: 0.035
chem comp atom.model cartn z: 24.366
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H5
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -1.539
chem comp atom.pdbx model cartn y ideal: 2.113
chem comp atom.pdbx model cartn z ideal: 1.152
chem comp atom.pdbx ordinal: 22
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H6,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H6
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H6
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.702
chem comp atom.model cartn y: -1.879
chem comp atom.model cartn z: 20.838
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H6
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -2.878
chem comp atom.pdbx model cartn y ideal: -0.329
chem comp atom.pdbx model cartn z ideal: -1.885
chem comp atom.pdbx ordinal: 23
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H7,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H7
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H7
chem comp atom.charge: 0
chem comp atom.model cartn x: 11.775
chem comp atom.model cartn y: -2.596
chem comp atom.model cartn z: 22.483
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H7
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -2.265
chem comp atom.pdbx model cartn y ideal: -1.406
chem comp atom.pdbx model cartn z ideal: -0.598
chem comp atom.pdbx ordinal: 24
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H8,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H8
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H8
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.155
chem comp atom.model cartn y: -1.708
chem comp atom.model cartn z: 20.258
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H8
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -4.502
chem comp atom.pdbx model cartn y ideal: -2.207
chem comp atom.pdbx model cartn z ideal: 0.314
chem comp atom.pdbx ordinal: 25
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H9,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H9
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H9
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.936
chem comp atom.model cartn y: -0.233
chem comp atom.model cartn z: 20.923
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H9
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -5.144
chem comp atom.pdbx model cartn y ideal: -1.046
chem comp atom.pdbx model cartn z ideal: 1.594
chem comp atom.pdbx ordinal: 26
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H10,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H10
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H10
chem comp atom.charge: 0
chem comp atom.model cartn x: 14.332
chem comp atom.model cartn y: -2.854
chem comp atom.model cartn z: 22.594
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H10
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -6.013
chem comp atom.pdbx model cartn y ideal: 0.487
chem comp atom.pdbx model cartn z ideal: -0.232
chem comp atom.pdbx ordinal: 27
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H11,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H11
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H11
chem comp atom.charge: 0
chem comp atom.model cartn x: 15.113
chem comp atom.model cartn y: -1.379
chem comp atom.model cartn z: 23.259
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H11
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -5.371
chem comp atom.pdbx model cartn y ideal: -0.674
chem comp atom.pdbx model cartn z ideal: -1.513
chem comp atom.pdbx ordinal: 28
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H12,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H12
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H12
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.658
chem comp atom.model cartn y: 0.542
chem comp atom.model cartn z: 23.685
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H12
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -3.915
chem comp atom.pdbx model cartn y ideal: 1.059
chem comp atom.pdbx model cartn z ideal: 1.888
chem comp atom.pdbx ordinal: 29
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H13,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H13
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H13
chem comp atom.charge: 0
chem comp atom.model cartn x: 13.119
chem comp atom.model cartn y: 1.234
chem comp atom.model cartn z: 22.118
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H13
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: -3.832
chem comp atom.pdbx model cartn y ideal: 2.068
chem comp atom.pdbx model cartn z ideal: 0.409
chem comp atom.pdbx ordinal: 30
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H14,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H14
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H14
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.786
chem comp atom.model cartn y: -0.320
chem comp atom.model cartn z: 22.076
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H14
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 3.248
chem comp atom.pdbx model cartn y ideal: 2.882
chem comp atom.pdbx model cartn z ideal: 0.569
chem comp atom.pdbx ordinal: 31
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H15,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H15
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H15
chem comp atom.charge: 0
chem comp atom.model cartn x: 7.236
chem comp atom.model cartn y: 0.687
chem comp atom.model cartn z: 22.412
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H15
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 4.149
chem comp atom.pdbx model cartn y ideal: 2.618
chem comp atom.pdbx model cartn z ideal: -0.943
chem comp atom.pdbx ordinal: 32
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H16,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H16
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H16
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.702
chem comp atom.model cartn y: 1.465
chem comp atom.model cartn z: 21.895
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H16
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 2.371
chem comp atom.pdbx model cartn y ideal: 2.559
chem comp atom.pdbx model cartn z ideal: -0.946
chem comp atom.pdbx ordinal: 33
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H17,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H17
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H17
chem comp atom.charge: 0
chem comp atom.model cartn x: 5.750
chem comp atom.model cartn y: 1.271
chem comp atom.model cartn z: 17.232
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H17
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 5.475
chem comp atom.pdbx model cartn y ideal: -1.678
chem comp atom.pdbx model cartn z ideal: 0.438
chem comp atom.pdbx ordinal: 34
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

H18,L4N
type: chem comp atom
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
chem comp atom.atom id: H18
chem comp atom.comp id: L4N
chem comp atom.alt atom id: H18
chem comp atom.charge: 0
chem comp atom.model cartn x: 4.990
chem comp atom.model cartn y: 1.363
chem comp atom.model cartn z: 19.544
chem comp atom.pdbx align: 1
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx component atom id: H18
chem comp atom.pdbx component comp id: L4N
chem comp atom.pdbx leaving atom flag: N
chem comp atom.pdbx model cartn x ideal: 5.457
chem comp atom.pdbx model cartn y ideal: 0.737
chem comp atom.pdbx model cartn z ideal: -0.041
chem comp atom.pdbx ordinal: 35
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H

N,C3,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: N
chem comp bond.atom id 2: C3
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 1
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

N,C4,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: N
chem comp bond.atom id 2: C4
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 2
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,C2,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: C2
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 3
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,C5,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: C5
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 4
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C2,C1,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C1
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 5
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C5,C1,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C1
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: Y
chem comp bond.pdbx ordinal: 6
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,N1,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: N1
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 7
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,C,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: C
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 8
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O,C6,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: O
chem comp bond.atom id 2: C6
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 9
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

N1,C6,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: C6
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 10
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C12,C10,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: C10
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 11
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C12,C11,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: C11
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 12
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C6,C7,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: C7
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 13
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C13,C10,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: C10
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 14
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C13,C7,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: C7
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 15
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C10,C11,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C10
chem comp bond.atom id 2: C11
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 16
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C10,C9,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C10
chem comp bond.atom id 2: C9
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 17
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C7,C8,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: C8
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 18
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C9,C8,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: C8
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 19
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N1,H1,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: N1
chem comp bond.atom id 2: H1
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 20
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,H2,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H2
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 21
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C7,H3,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: H3
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 22
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C8,H4,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H4
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 23
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C8,H5,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H5
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 24
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C13,H6,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: H6
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 25
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C13,H7,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: H7
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 26
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C12,H8,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: H8
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 27
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C12,H9,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: H9
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 28
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C11,H10,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: H10
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 29
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C11,H11,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: H11
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 30
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C9,H12,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: H12
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 31
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C9,H13,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: H13
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 32
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,H14,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C
chem comp bond.atom id 2: H14
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 33
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,H15,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C
chem comp bond.atom id 2: H15
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 34
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C,H16,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C
chem comp bond.atom id 2: H16
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 35
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,H17,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H17
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 36
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,H18,L4N
type: chem comp bond
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
reference to chem comp atom: http://rdf.wwpdb.org/cc/L4N/chem_comp_atom/,
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H18
chem comp bond.comp id: L4N
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 37
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

Create component,L4N,2023-08-15
type: pdbx chem comp audit
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp audit.action type: Create component
pdbx chem comp audit.comp id: L4N
pdbx chem comp audit.date: 2023-08-15
pdbx chem comp audit.processing site: RCSB

Initial release,L4N,2023-11-08
type: pdbx chem comp audit
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp audit.action type: Initial release
pdbx chem comp audit.comp id: L4N
pdbx chem comp audit.date: 2023-11-08
pdbx chem comp audit.processing site: RCSB

L4N,ACDLabs,12.01,SMILES
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: ACDLabs
pdbx chem comp descriptor.program version: 12.01
pdbx chem comp descriptor.type: SMILES
pdbx chem comp descriptor.descriptor: O=C(Nc1cnccc1C)C1CCC2(CC2)C1

L4N,InChI,1.06,InChI
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: InChI
pdbx chem comp descriptor.program version: 1.06
pdbx chem comp descriptor.type: InChI
pdbx chem comp descriptor.descriptor: InChI=1S/C14H18N2O/c1-10-3-7-15-9-12(10)16-13(17)11-2-4-14(8-11)5-6-14/h3,7,9,11H,2,4-6,8H2,1H3,(H,16,17)/t11-/m1/s1

L4N,InChI,1.06,InChIKey
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: InChI
pdbx chem comp descriptor.program version: 1.06
pdbx chem comp descriptor.type: InChIKey
pdbx chem comp descriptor.descriptor: FNCISWRYQRGLKF-LLVKDONJSA-N

L4N,CACTVS,3.385,SMILES CANONICAL
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: CACTVS
pdbx chem comp descriptor.program version: 3.385
pdbx chem comp descriptor.type: SMILES_CANONICAL
pdbx chem comp descriptor.descriptor: Cc1ccncc1NC(=O)[C@@H]2CCC3(CC3)C2

L4N,CACTVS,3.385,SMILES
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: CACTVS
pdbx chem comp descriptor.program version: 3.385
pdbx chem comp descriptor.type: SMILES
pdbx chem comp descriptor.descriptor: Cc1ccncc1NC(=O)[CH]2CCC3(CC3)C2

L4N,OpenEye OEToolkits,2.0.7,SMILES CANONICAL
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: OpenEye OEToolkits
pdbx chem comp descriptor.program version: 2.0.7
pdbx chem comp descriptor.type: SMILES_CANONICAL
pdbx chem comp descriptor.descriptor: Cc1ccncc1NC(=O)[C@@H]2CCC3(C2)CC3

L4N,OpenEye OEToolkits,2.0.7,SMILES
type: pdbx chem comp descriptor
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp descriptor.comp id: L4N
pdbx chem comp descriptor.program: OpenEye OEToolkits
pdbx chem comp descriptor.program version: 2.0.7
pdbx chem comp descriptor.type: SMILES
pdbx chem comp descriptor.descriptor: Cc1ccncc1NC(=O)C2CCC3(C2)CC3

L4N,ACDLabs,12.01,SYSTEMATIC NAME
type: pdbx chem comp identifier
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp identifier.comp id: L4N
pdbx chem comp identifier.program: ACDLabs
pdbx chem comp identifier.program version: 12.01
pdbx chem comp identifier.type: SYSTEMATIC NAME
pdbx chem comp identifier.identifier: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide

L4N,OpenEye OEToolkits,2.0.7,SYSTEMATIC NAME
type: pdbx chem comp identifier
of datablock: (5R)-N-(4-methylpyridin-3-yl)spiro[2.4]heptane-5-carboxamide
reference to chem comp: chem comp
pdbx chem comp identifier.comp id: L4N
pdbx chem comp identifier.program: OpenEye OEToolkits
pdbx chem comp identifier.program version: 2.0.7
pdbx chem comp identifier.type: SYSTEMATIC NAME
pdbx chem comp identifier.identifier: (6~{R})-~{N}-(4-methylpyridin-3-yl)spiro[2.4]heptane-6-carboxamide