1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide

C163H165F4N21O16S2 — CID 161086765

IUPAC1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide
SMILESCc1ccc(NC(=O)C2CCCN(C(=O)C3=Nc4ccccc4C3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)Cc3cc4ccccc4o3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3csc(-c4ccccc4)n3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3nc(-c4ccccc4)oc3C)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3sc(-c4ccccc4)nc3C)C2)cc1.Cc1ccc(NC(=O)C2CN(C(=O)Cc3nc4ccccc4[nH]3)CC(F)(F)C2)cc1.Cc1ccc(NC(=O)C2CN(C(=O)c3cccc(-c4ccncc4)c3)CC(F)(F)C2)cc1
InChIInChI=1S/C25H23F2N3O2.C24H25N3O3.C24H25N3O2S.C23H23N3O2S.C23H24N2O3.C22H22F2N4O2.C22H23N3O2/c1-17-5-7-22(8-6-17)29-23(31)21-14-25(26,27)16-30(15-21)24(32)20-4-2-3-19(13-20)18-9-11-28-12-10-18;1-16-10-12-20(13-11-16)25-22(28)19-9-6-14-27(15-19)24(29)21-17(2)30-23(26-21)18-7-4-3-5-8-18;1-16-10-12-20(13-11-16)26-22(28)19-9-6-14-27(15-19)24(29)21-17(2)25-23(30-21)18-7-4-3-5-8-18;1-16-9-11-19(12-10-16)24-21(27)18-8-5-13-26(14-18)23(28)20-15-29-22(25-20)17-6-3-2-4-7-17;1-16-8-10-19(11-9-16)24-23(27)18-6-4-12-25(15-18)22(26)14-20-13-17-5-2-3-7-21(17)28-20;1-14-6-8-16(9-7-14)25-21(30)15-11-22(23,24)13-28(12-15)20(29)10-19-26-17-4-2-3-5-18(17)27-19;1-15-8-10-18(11-9-15)23-21(26)17-6-4-12-25(14-17)22(27)20-13-16-5-2-3-7-19(16)24-20/h2-13,21H,14-16H2,1H3,(H,29,31);3-5,7-8,10-13,19H,6,9,14-15H2,1-2H3,(H,25,28);3-5,7-8,10-13,19H,6,9,14-15H2,1-2H3,(H,26,28);2-4,6-7,9-12,15,18H,5,8,13-14H2,1H3,(H,24,27);2-3,5,7-11,13,18H,4,6,12,14-15H2,1H3,(H,24,27);2-9,15H,10-13H2,1H3,(H,25,30)(H,26,27);2-3,5,7-11,17H,4,6,12-14H2,1H3,(H,23,26)
InChIKeyUGPUMJSKDDLMHX-UHFFFAOYSA-N
MW2814.37 g/mol
LogP29.97
Rot. Bonds27

About 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide

1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide (PubChem CID 161086765) has the molecular formula C163H165F4N21O16S2 and a molecular weight of 2814.37 g/mol. Its IUPAC name is 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide
PubChem CID161086765
Molecular FormulaC163H165F4N21O16S2
Molecular Weight2814.37 g/mol
Exact Mass2812.21
IUPAC Name1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide
SMILESCc1ccc(NC(=O)C2CCCN(C(=O)C3=Nc4ccccc4C3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)Cc3cc4ccccc4o3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3csc(-c4ccccc4)n3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3nc(-c4ccccc4)oc3C)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3sc(-c4ccccc4)nc3C)C2)cc1.Cc1ccc(NC(=O)C2CN(C(=O)Cc3nc4ccccc4[nH]3)CC(F)(F)C2)cc1.Cc1ccc(NC(=O)C2CN(C(=O)c3cccc(-c4ccncc4)c3)CC(F)(F)C2)cc1
InChIInChI=1S/C25H23F2N3O2.C24H25N3O3.C24H25N3O2S.C23H23N3O2S.C23H24N2O3.C22H22F2N4O2.C22H23N3O2/c1-17-5-7-22(8-6-17)29-23(31)21-14-25(26,27)16-30(15-21)24(32)20-4-2-3-19(13-20)18-9-11-28-12-10-18;1-16-10-12-20(13-11-16)25-22(28)19-9-6-14-27(15-19)24(29)21-17(2)30-23(26-21)18-7-4-3-5-8-18;1-16-10-12-20(13-11-16)26-22(28)19-9-6-14-27(15-19)24(29)21-17(2)25-23(30-21)18-7-4-3-5-8-18;1-16-9-11-19(12-10-16)24-21(27)18-8-5-13-26(14-18)23(28)20-15-29-22(25-20)17-6-3-2-4-7-17;1-16-8-10-19(11-9-16)24-23(27)18-6-4-12-25(15-18)22(26)14-20-13-17-5-2-3-7-21(17)28-20;1-14-6-8-16(9-7-14)25-21(30)15-11-22(23,24)13-28(12-15)20(29)10-19-26-17-4-2-3-5-18(17)27-19;1-15-8-10-18(11-9-15)23-21(26)17-6-4-12-25(14-17)22(27)20-13-16-5-2-3-7-19(16)24-20/h2-13,21H,14-16H2,1H3,(H,29,31);3-5,7-8,10-13,19H,6,9,14-15H2,1-2H3,(H,25,28);3-5,7-8,10-13,19H,6,9,14-15H2,1-2H3,(H,26,28);2-4,6-7,9-12,15,18H,5,8,13-14H2,1H3,(H,24,27);2-3,5,7-11,13,18H,4,6,12,14-15H2,1H3,(H,24,27);2-9,15H,10-13H2,1H3,(H,25,30)(H,26,27);2-3,5,7-11,17H,4,6,12-14H2,1H3,(H,23,26)
InChIKeyUGPUMJSKDDLMHX-UHFFFAOYSA-N
XLogP29.97
TPSA464.75 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds27
Heavy Atoms206
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002814.37
LogP ≤ 529.97
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Analyze 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide with MolForge

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Related Compounds

1-cyclohexyl-3-propan-2-ylbenzene;1-cyclopentyl-3-propan-2-ylbenzene;2-methyl-4-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;1-(2-propan-2-ylphenyl)pyrrolidine;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 157464689
CID 157497476
CID 157497476
(2'R,4'S,4'aS)-2',4'-dimethyl-8'-[4-(1,3-oxazol-2-yl)-1,3-oxazol-2-yl]spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'R,4'S,4'aS)-2',4'-dimethyl-8'-[5-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'S,4'S,4'aS)-10'-fluoro-8'-[3-(1H-imidazol-2-yl)propanoyl]-4'-methyl-2'-(trifluoromethyl)spiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'R,4'S,4'aS)-8'-(6-fluoro-3-pyridinyl)-2',4'-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione;(2'R,4'S,4'aS)-8'-[5-(1H-imidazol-2-yl)-1H-imidazol-2-yl]-2',4'-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-[1,4]oxazino[4,3-a]quinoline]-2,4,6-trione
CID 158293483
1H-benzimidazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzothiazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzoxazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazo[4,5-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-pyrrol-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158306259
5-[5-(4,4-difluoro-6,7-dihydro-5H-1,3-benzothiazol-2-yl)-3-pyridinyl]-N-methyl-2-(4-methylphenyl)-6-(2-oxopyrrolidin-1-yl)-1-benzofuran-3-carboxamide;5-[5-(4-fluoro-1,3-benzoxazol-2-yl)-6-methoxy-3-pyridinyl]-N-methyl-2-(4-methylphenyl)-6-(2-oxopyrrolidin-1-yl)-1-benzofuran-3-carboxamide;5-[5-(4-fluoro-1,3-benzoxazol-2-yl)-1-methylpyrrol-3-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;5-[5-(4-fluoro-1,3-benzoxazol-2-yl)-6-oxo-1H-pyridin-3-yl]-N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-5-[1-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyrrol-3-yl]-2-(4-methylphenyl)-1-benzofuran-3-carboxamide;N-methyl-6-[methyl(methylsulfonyl)amino]-2-(4-methylphenyl)-5-[5-([1,3]oxazolo[4,5-b]pyridin-2-yl)-6-oxo-1H-pyridin-3-yl]-1-benzofuran-3-carboxamide
CID 158535993
2-(2,3-dihydro-1-benzofuran-5-yl)-4-methyl-1,3-thiazole;5-ethyl-2-propan-2-ylpyridine;1-(4-fluorophenyl)-4-methyl-5-(trifluoromethyl)imidazole;5-methoxy-2-propan-2-ylpyridine;4-methyl-1-phenyl-5-(trifluoromethyl)imidazole;4-methyl-2-phenyl-5-(trifluoromethyl)-1,3-oxazole;2-methyl-5-propan-2-ylpyridine;5-propan-2-yl-4H-furo[3,2-b]pyrrole;2-propan-2-yl-5-propan-2-yloxypyridine;5-propan-2-yl-2-propan-2-yloxypyridine;2-(5-propan-2-yl-2-pyridinyl)propan-2-ol;3-propan-2-yl-7-(trifluoromethyl)-1H-quinolin-4-one
CID 158732687
2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-ylnaphthalene;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine;2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine;3-propan-2-yl-5-(trifluoromethyl)pyridine;4-propan-2-yl-2-(trifluoromethyl)pyridine
CID 159430087
CID 159745877
CID 159745877
N-[3-[[4-(1-benzofuran-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[[4-(furan-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(4-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(4-thiophen-2-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide
CID 159780650
6-[4-(1,1-Difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-phenoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160025166
N-[2-[4-[4-(5-isocyano-1H-indol-3-yl)butyl]piperazin-1-yl]-5-[4-(2,2,3-trifluorobutoxy)phenyl]-3-pyridinyl]formamide;2-[4-[3-(5-isocyano-1H-indol-3-yl)propyl]piperazin-1-yl]-5-methyl-4-phenyl-1,3-oxazole;2-[4-[3-(5-isocyano-1H-indol-3-yl)propyl]piperazin-1-yl]-4-methyl-5-phenyl-1,3-thiazole;2-[4-[3-(5-isocyano-1H-indol-3-yl)propyl]piperazin-1-yl]-5-methyl-4-phenyl-1,3-thiazole;2-[4-[3-(5-isocyano-1H-indol-3-yl)propyl]piperazin-1-yl]-5-phenyl-4-(trifluoromethyl)-1,3-oxazole;2-[4-[3-(5-isocyano-1H-indol-3-yl)propyl]piperazin-1-yl]-5-[4-(2,2,3-trifluorobutoxy)phenyl]pyridine-3-carboxamide
CID 160143860
6-[4-(1,1-difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;methyl (E)-3-[6-[4-(1,1-difluoroethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,5-a]pyridin-1-yl]prop-2-enoate;6-(4-phenoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160204499

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide (CID 161086765) is 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide is Cc1ccc(NC(=O)C2CCCN(C(=O)C3=Nc4ccccc4C3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)Cc3cc4ccccc4o3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3csc(-c4ccccc4)n3)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3nc(-c4ccccc4)oc3C)C2)cc1.Cc1ccc(NC(=O)C2CCCN(C(=O)c3sc(-c4ccccc4)nc3C)C2)cc1.Cc1ccc(NC(=O)C2CN(C(=O)Cc3nc4ccccc4[nH]3)CC(F)(F)C2)cc1.Cc1ccc(NC(=O)C2CN(C(=O)c3cccc(-c4ccncc4)c3)CC(F)(F)C2)cc1.
What is the InChIKey of 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide?
The InChIKey is UGPUMJSKDDLMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23F2N3O2.C24H25N3O3.C24H25N3O2S.C23H23N3O2S.C23H24N2O3.C22H22F2N4O2.C22H23N3O2/c1-17-5-7-22(8-6-17)29-23(31)21-14-25(26,27)16-30(15-21)24(32)20-4-2-3-19(13-20)18-9-11-28-12-10-18;1-16-10-12-20(13-11-16)25-22(28)19-9-6-14-27(15-19)24(29)21-17(2)30-23(26-21)18-7-4-3-5-8-18;1-16-10-12-20(13-11-16)26-22(28)19-9-6-14-27(15-19)24(29)21-17(2)25-23(30-21)18-7-4-3-5-8-18;1-16-9-11-19(12-10-16)24-21(27)18-8-5-13-26(14-18)23(28)20-15-29-22(25-20)17-6-3-2-4-7-17;1-16-8-10-19(11-9-16)24-23(27)18-6-4-12-25(15-18)22(26)14-20-13-17-5-2-3-7-21(17)28-20;1-14-6-8-16(9-7-14)25-21(30)15-11-22(23,24)13-28(12-15)20(29)10-19-26-17-4-2-3-5-18(17)27-19;1-15-8-10-18(11-9-15)23-21(26)17-6-4-12-25(14-17)22(27)20-13-16-5-2-3-7-19(16)24-20/h2-13,21H,14-16H2,1H3,(H,29,31);3-5,7-8,10-13,19H,6,9,14-15H2,1-2H3,(H,25,28);3-5,7-8,10-13,19H,6,9,14-15H2,1-2H3,(H,26,28);2-4,6-7,9-12,15,18H,5,8,13-14H2,1H3,(H,24,27);2-3,5,7-11,13,18H,4,6,12,14-15H2,1H3,(H,24,27);2-9,15H,10-13H2,1H3,(H,25,30)(H,26,27);2-3,5,7-11,17H,4,6,12-14H2,1H3,(H,23,26).
What are the key properties of 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide?
1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide has a molecular weight of 2814.37 g/mol, XLogP of 29.97, 27 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1H-benzimidazol-2-yl)acetyl]-5,5-difluoro-N-(4-methylphenyl)piperidine-3-carboxamide;1-[2-(1-benzofuran-2-yl)acetyl]-N-(4-methylphenyl)piperidine-3-carboxamide;5,5-difluoro-N-(4-methylphenyl)-1-(3-pyridin-4-ylbenzoyl)piperidine-3-carboxamide;1-(3H-indole-2-carbonyl)-N-(4-methylphenyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(5-methyl-2-phenyl-1,3-oxazole-4-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)piperidine-3-carboxamide;N-(4-methylphenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 161086765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).