[(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone

C192H240F3N21O7 — CID 158074730

IUPAC[(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone
SMILESC.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2ccc(-c4ccccc4)nc23)[C@H](c2ccccc2)C1.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2nc4c(cc23)CCCC4)[C@H](c2ccccc2)C1.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2nccc(C(F)(F)F)c23)[C@H](c2ccccc2)C1.Cc1cc(C)c2c(n1)CCC[C@]21CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1ccc2c(n1)[C@]1(CCC2)CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1ccnc2c1[C@]1(CCC2)CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1cnc2c(c1)CCC[C@]21CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1
InChIInChI=1S/C31H35N3O.C29H37N3O.C27H35N3O.C26H30F3N3O.3C26H33N3O.CH4/c1-22-16-18-34(28(19-22)24-11-6-3-7-12-24)30(35)26-20-32-21-31(26)17-8-13-25-14-15-27(33-29(25)31)23-9-4-2-5-10-23;1-20-13-15-32(27(16-20)21-8-3-2-4-9-21)28(33)24-18-30-19-29(24)14-7-12-26-23(29)17-22-10-5-6-11-25(22)31-26;1-18-11-13-30(24(14-18)21-8-5-4-6-9-21)26(31)22-16-28-17-27(22)12-7-10-23-25(27)19(2)15-20(3)29-23;1-17-10-13-32(22(14-17)18-6-3-2-4-7-18)24(33)20-15-30-16-25(20)11-5-8-21-23(25)19(9-12-31-21)26(27,28)29;1-18-11-14-29(23(15-18)20-7-4-3-5-8-20)25(30)21-16-27-17-26(21)12-6-9-22-24(26)19(2)10-13-28-22;1-18-12-14-29(23(15-18)20-7-4-3-5-8-20)25(30)22-16-27-17-26(22)13-6-9-21-11-10-19(2)28-24(21)26;1-18-10-12-29(23(14-18)20-7-4-3-5-8-20)25(30)22-16-27-17-26(22)11-6-9-21-13-19(2)15-28-24(21)26;/h2-7,9-12,14-15,22,26,28,32H,8,13,16-21H2,1H3;2-4,8-9,17,20,24,27,30H,5-7,10-16,18-19H2,1H3;4-6,8-9,15,18,22,24,28H,7,10-14,16-17H2,1-3H3;2-4,6-7,9,12,17,20,22,30H,5,8,10-11,13-16H2,1H3;3-5,7-8,10,13,18,21,23,27H,6,9,11-12,14-17H2,1-2H3;3-5,7-8,10-11,18,22-23,27H,6,9,12-17H2,1-2H3;3-5,7-8,13,15,18,22-23,27H,6,9-12,14,16-17H2,1-2H3;1H4/t22-,26?,28+,31-;20-,24?,27+,29+;18-,22?,24+,27-;17-,20?,22+,25-;18-,21?,23+,26-;2*18-,22?,23+,26-;/m1111111./s1
InChIKeyFMFQYDGVFSCMOQ-YUOGWXSGSA-N
MW3011.17 g/mol
LogP32.87
Rot. Bonds15

About [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone

[(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone (PubChem CID 158074730) has the molecular formula C192H240F3N21O7 and a molecular weight of 3011.17 g/mol. Its IUPAC name is [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone.

Molecular Properties

Compound Name[(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone
PubChem CID158074730
Molecular FormulaC192H240F3N21O7
Molecular Weight3011.17 g/mol
Exact Mass3008.90
IUPAC Name[(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone
SMILESC.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2ccc(-c4ccccc4)nc23)[C@H](c2ccccc2)C1.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2nc4c(cc23)CCCC4)[C@H](c2ccccc2)C1.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2nccc(C(F)(F)F)c23)[C@H](c2ccccc2)C1.Cc1cc(C)c2c(n1)CCC[C@]21CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1ccc2c(n1)[C@]1(CCC2)CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1ccnc2c1[C@]1(CCC2)CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1cnc2c(c1)CCC[C@]21CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1
InChIInChI=1S/C31H35N3O.C29H37N3O.C27H35N3O.C26H30F3N3O.3C26H33N3O.CH4/c1-22-16-18-34(28(19-22)24-11-6-3-7-12-24)30(35)26-20-32-21-31(26)17-8-13-25-14-15-27(33-29(25)31)23-9-4-2-5-10-23;1-20-13-15-32(27(16-20)21-8-3-2-4-9-21)28(33)24-18-30-19-29(24)14-7-12-26-23(29)17-22-10-5-6-11-25(22)31-26;1-18-11-13-30(24(14-18)21-8-5-4-6-9-21)26(31)22-16-28-17-27(22)12-7-10-23-25(27)19(2)15-20(3)29-23;1-17-10-13-32(22(14-17)18-6-3-2-4-7-18)24(33)20-15-30-16-25(20)11-5-8-21-23(25)19(9-12-31-21)26(27,28)29;1-18-11-14-29(23(15-18)20-7-4-3-5-8-20)25(30)21-16-27-17-26(21)12-6-9-22-24(26)19(2)10-13-28-22;1-18-12-14-29(23(15-18)20-7-4-3-5-8-20)25(30)22-16-27-17-26(22)13-6-9-21-11-10-19(2)28-24(21)26;1-18-10-12-29(23(14-18)20-7-4-3-5-8-20)25(30)22-16-27-17-26(22)11-6-9-21-13-19(2)15-28-24(21)26;/h2-7,9-12,14-15,22,26,28,32H,8,13,16-21H2,1H3;2-4,8-9,17,20,24,27,30H,5-7,10-16,18-19H2,1H3;4-6,8-9,15,18,22,24,28H,7,10-14,16-17H2,1-3H3;2-4,6-7,9,12,17,20,22,30H,5,8,10-11,13-16H2,1H3;3-5,7-8,10,13,18,21,23,27H,6,9,11-12,14-17H2,1-2H3;3-5,7-8,10-11,18,22-23,27H,6,9,12-17H2,1-2H3;3-5,7-8,13,15,18,22-23,27H,6,9-12,14,16-17H2,1-2H3;1H4/t22-,26?,28+,31-;20-,24?,27+,29+;18-,22?,24+,27-;17-,20?,22+,25-;18-,21?,23+,26-;2*18-,22?,23+,26-;/m1111111./s1
InChIKeyFMFQYDGVFSCMOQ-YUOGWXSGSA-N
XLogP32.87
TPSA316.61 Ų
H-Bond Donors7
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms223
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003011.17
LogP ≤ 532.87
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1021

Analyze [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone with MolForge

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Related Compounds

(3S)-2-[(2S)-2-[[2-[[(1S)-2-[(3S)-2-[(2S)-2-[[2-[[(1S)-2-[(3S)-2-[(2S)-2-[[2-[[(1S)-2-[(3S)-2-[(2S)-2-[(2-acetamidoacetyl)amino]-3-phenylpropanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]-1,3,3a,4,5,6,7,7a-octahydroisoindole-1-carbonyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]-1,3,3a,4,5,6,7,7a-octahydroisoindole-1-carbonyl]amino]acetyl]amino]-3-phenylpropanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]-1,3,3a,4,5,6,7,7a-octahydroisoindole-1-carbonyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]-N-[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 73354247
5-amino-6-pyridin-3-yl-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-trien-11-one;7-amino-6-pyridin-3-yl-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one;7-(methylamino)-6-pyridin-3-yl-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one;5-nitro-6-pyridin-3-yl-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-trien-11-one;7-nitro-6-pyridin-3-yl-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one;2,2,2-trifluoro-N-(11-oxo-6-pyridin-3-yl-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-trien-5-yl)acetamide
CID 157274729
(4R)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;(4S)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;bis(4-(4-fluorophenyl)-8-(4-naphthalen-2-yl-4-oxobutyl)-2,8-diazaspiro[4.5]decan-1-one);4-(4-fluorophenyl)-8-(4-oxo-4-quinolin-3-ylbutyl)-2,8-diazaspiro[4.5]decan-1-one;methane;hexakis(2,2,2-trifluoroacetic acid)
CID 157674471
4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-naphthalen-2-yl-4-oxobutyl]-2,8-diazaspiro[4.5]decan-1-one;(4R)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;(4S)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;bis(4-(4-fluorophenyl)-8-(4-naphthalen-2-yl-4-oxobutyl)-2,8-diazaspiro[4.5]decan-1-one);pentakis(2,2,2-trifluoroacetic acid)
CID 157859796
[(2S,4R)-2,4-diphenylpiperidin-1-yl]-[(3'S,5R)-2-methylspiro[7,8-dihydro-6H-quinazoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2,4-diphenylpiperidin-1-yl]-[(3'S,5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2,4-diphenylpiperidin-1-yl]-[(3'S,8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2,4-diphenylpiperidin-1-yl]-[(3'S,5R)-2-phenylspiro[7,8-dihydro-6H-quinazoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2,4-diphenylpiperidin-1-yl]-[(3'S,8S)-spiro[6,7-dihydro-5H-quinoxaline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2,4-diphenylpiperidin-1-yl]-[(3'S,5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone
CID 158649781
(7S)-N-[3-amino-2-(methyliminomethyl)prop-2-enyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[3-(2-oxopyrrolidin-1-yl)propyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-(2-piperidin-1-ylethyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(4-propanoylcyclohexyl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-7-propan-2-yl-N-(pyridin-2-ylmethyl)-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 158855925
[2-[[(1R)-1-phenylethyl]amino]-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]methanone;[2-[[(1S)-1-phenylethyl]amino]-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]methanone;[2-[2-(2-phenylphenyl)ethylamino]-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]methanone;[2-[2-(4-phenylphenyl)ethylamino]-2,3,4,5,6,6a-hexahydro-1H-pentalen-3a-yl]-[3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]methanone
CID 159050753
(2-tert-butyl-4-phenylpiperidin-1-yl)-[(3'S,5R)-2-chlorospiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2-(4,4-difluorocyclohexyl)-4-(2-fluorophenyl)piperidin-1-yl]-[(3'S,5R)-2-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2-(3,3-difluorocyclohexyl)-4-phenylpiperidin-1-yl]-[(3'S,5R)-2-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-2-(4,4-difluorocyclohexyl)-4-phenylpiperidin-1-yl]-[(3'S,5R)-2-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(3'S,5R)-2-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-phenyl-2-(2,2,2-trifluoroethyl)piperidin-1-yl]methanone
CID 159051003
N-benzyl-4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]benzamide;N-(3,3-diphenylpropyl)-4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]benzamide;N-hexyl-4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]benzamide;N-methyl-N-pyridin-4-yl-4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]benzamide;N-pyridin-4-yl-4-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]benzamide;N-pyridin-4-yl-4-[5-pyridin-3-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide
CID 159682919
CID 159692331
CID 159692331
N-(2,3-difluorophenyl)-4-(3,5-difluorophenyl)-1-methyl-2-oxopyrrolidine-3-carboxamide;N-(2,4-difluorophenyl)-4-(3,5-difluorophenyl)-1-methyl-2-oxopyrrolidine-3-carboxamide;4-(3,5-difluorophenyl)-N-(4-fluoro-2-methylphenyl)-2-oxopyrrolidine-3-carboxamide;4-(3,5-difluorophenyl)-N-[3-fluoro-2-(trifluoromethyl)phenyl]-1-methyl-2-oxopyrrolidine-3-carboxamide;N-(2,3-difluorophenyl)-4-(6-methyl-3-pyridinyl)-2-oxopyrrolidine-3-carboxamide;N-(2,3-difluorophenyl)-2-oxo-4-(3-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 159750293
(3R,4S)-1-benzyl-3-fluoro-4-(5-fluoro-2-pyridinyl)pyrrolidine-3-carboxylic acid;methyl 1-[2-[(3S,4R)-1-[(3R,4S)-1-benzyl-3-fluoro-4-(5-fluoro-2-pyridinyl)pyrrolidine-3-carbonyl]-4-ethylpyrrolidin-3-yl]-5-(trifluoromethyl)phenyl]piperidine-4-carboxylate;methyl 1-[2-[(3S,4R)-4-ethyl-1-[(3R,4S)-3-fluoro-4-(5-fluoro-2-pyridinyl)pyrrolidine-3-carbonyl]pyrrolidin-3-yl]-5-(trifluoromethyl)phenyl]piperidine-4-carboxylate;methyl 1-[2-[(3S,4R)-4-ethylpyrrolidin-3-yl]-5-(trifluoromethyl)phenyl]piperidine-4-carboxylate
CID 159810385

Frequently Asked Questions

What is the IUPAC name of [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone?
The IUPAC name of [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone (CID 158074730) is [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone.
What is the SMILES notation for [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone?
The canonical SMILES for [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone is C.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2ccc(-c4ccccc4)nc23)[C@H](c2ccccc2)C1.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2nc4c(cc23)CCCC4)[C@H](c2ccccc2)C1.C[C@@H]1CCN(C(=O)C2CNC[C@]23CCCc2nccc(C(F)(F)F)c23)[C@H](c2ccccc2)C1.Cc1cc(C)c2c(n1)CCC[C@]21CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1ccc2c(n1)[C@]1(CCC2)CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1ccnc2c1[C@]1(CCC2)CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.Cc1cnc2c(c1)CCC[C@]21CNCC1C(=O)N1CC[C@@H](C)C[C@H]1c1ccccc1.
What is the InChIKey of [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone?
The InChIKey is FMFQYDGVFSCMOQ-YUOGWXSGSA-N. The full InChI is InChI=1S/C31H35N3O.C29H37N3O.C27H35N3O.C26H30F3N3O.3C26H33N3O.CH4/c1-22-16-18-34(28(19-22)24-11-6-3-7-12-24)30(35)26-20-32-21-31(26)17-8-13-25-14-15-27(33-29(25)31)23-9-4-2-5-10-23;1-20-13-15-32(27(16-20)21-8-3-2-4-9-21)28(33)24-18-30-19-29(24)14-7-12-26-23(29)17-22-10-5-6-11-25(22)31-26;1-18-11-13-30(24(14-18)21-8-5-4-6-9-21)26(31)22-16-28-17-27(22)12-7-10-23-25(27)19(2)15-20(3)29-23;1-17-10-13-32(22(14-17)18-6-3-2-4-7-18)24(33)20-15-30-16-25(20)11-5-8-21-23(25)19(9-12-31-21)26(27,28)29;1-18-11-14-29(23(15-18)20-7-4-3-5-8-20)25(30)21-16-27-17-26(21)12-6-9-22-24(26)19(2)10-13-28-22;1-18-12-14-29(23(15-18)20-7-4-3-5-8-20)25(30)22-16-27-17-26(22)13-6-9-21-11-10-19(2)28-24(21)26;1-18-10-12-29(23(14-18)20-7-4-3-5-8-20)25(30)22-16-27-17-26(22)11-6-9-21-13-19(2)15-28-24(21)26;/h2-7,9-12,14-15,22,26,28,32H,8,13,16-21H2,1H3;2-4,8-9,17,20,24,27,30H,5-7,10-16,18-19H2,1H3;4-6,8-9,15,18,22,24,28H,7,10-14,16-17H2,1-3H3;2-4,6-7,9,12,17,20,22,30H,5,8,10-11,13-16H2,1H3;3-5,7-8,10,13,18,21,23,27H,6,9,11-12,14-17H2,1-2H3;3-5,7-8,10-11,18,22-23,27H,6,9,12-17H2,1-2H3;3-5,7-8,13,15,18,22-23,27H,6,9-12,14,16-17H2,1-2H3;1H4/t22-,26?,28+,31-;20-,24?,27+,29+;18-,22?,24+,27-;17-,20?,22+,25-;18-,21?,23+,26-;2*18-,22?,23+,26-;/m1111111./s1.
What are the key properties of [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone?
[(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone has a molecular weight of 3011.17 g/mol, XLogP of 32.87, 15 rotatable bonds, 7 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R)-2,4-dimethylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]methanone;methane;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-methylspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-3-methylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8S)-2-phenylspiro[6,7-dihydro-5H-quinoline-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(8R)-spiro[2,3,4,5,6,7-hexahydro-1H-acridine-8,4'-pyrrolidine]-3'-yl]methanone;[(2S,4R)-4-methyl-2-phenylpiperidin-1-yl]-[(5R)-4-(trifluoromethyl)spiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]methanone is sourced from PubChem (CID 158074730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).