3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide

C153H151Cl8F9N12O7 — CID 158170733

IUPAC3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide
SMILESC[C@@H](NC(=O)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1)c1ccc(C(F)(F)F)nc1.Cc1ncc([C@@H](CO)NC(=O)c2cc(-c3ccc(Cl)cc3)cc(C3CCCCC3)c2)cn1.O=C(NCC1CC1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ccc(C(F)(F)F)nc1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ccc(Cl)nc1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1
InChIInChI=1S/C27H26ClF3N2O.C26H23Cl2F3N2O.C26H24ClF3N2O.C26H28ClN3O2.C25H24Cl2N2O.C23H26ClNO/c1-17(20-9-12-25(32-16-20)27(29,30)31)33-26(34)23-14-21(18-5-3-2-4-6-18)13-22(15-23)19-7-10-24(28)11-8-19;27-22-8-6-17(7-9-22)19-10-18(16-4-2-1-3-5-16)11-20(12-19)25(34)33-15-24-23(28)13-21(14-32-24)26(29,30)31;27-23-9-7-19(8-10-23)21-12-20(18-4-2-1-3-5-18)13-22(14-21)25(33)32-16-17-6-11-24(31-15-17)26(28,29)30;1-17-28-14-23(15-29-17)25(16-31)30-26(32)22-12-20(18-5-3-2-4-6-18)11-21(13-22)19-7-9-24(27)10-8-19;26-23-9-7-19(8-10-23)21-12-20(18-4-2-1-3-5-18)13-22(14-21)25(30)29-16-17-6-11-24(27)28-15-17;24-22-10-8-18(9-11-22)20-12-19(17-4-2-1-3-5-17)13-21(14-20)23(26)25-15-16-6-7-16/h7-18H,2-6H2,1H3,(H,33,34);6-14,16H,1-5,15H2,(H,33,34);6-15,18H,1-5,16H2,(H,32,33);7-15,18,25,31H,2-6,16H2,1H3,(H,30,32);6-15,18H,1-5,16H2,(H,29,30);8-14,16-17H,1-7,15H2,(H,25,26)/t17-;;;25-;;/m1..1../s1
InChIKeyFXKLSIONWWILES-SFZSZEQMSA-N
MW2724.57 g/mol
LogP42.25
Rot. Bonds31

About 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide

3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide (PubChem CID 158170733) has the molecular formula C153H151Cl8F9N12O7 and a molecular weight of 2724.57 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide
PubChem CID158170733
Molecular FormulaC153H151Cl8F9N12O7
Molecular Weight2724.57 g/mol
Exact Mass2718.92
IUPAC Name3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide
SMILESC[C@@H](NC(=O)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1)c1ccc(C(F)(F)F)nc1.Cc1ncc([C@@H](CO)NC(=O)c2cc(-c3ccc(Cl)cc3)cc(C3CCCCC3)c2)cn1.O=C(NCC1CC1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ccc(C(F)(F)F)nc1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ccc(Cl)nc1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1
InChIInChI=1S/C27H26ClF3N2O.C26H23Cl2F3N2O.C26H24ClF3N2O.C26H28ClN3O2.C25H24Cl2N2O.C23H26ClNO/c1-17(20-9-12-25(32-16-20)27(29,30)31)33-26(34)23-14-21(18-5-3-2-4-6-18)13-22(15-23)19-7-10-24(28)11-8-19;27-22-8-6-17(7-9-22)19-10-18(16-4-2-1-3-5-16)11-20(12-19)25(34)33-15-24-23(28)13-21(14-32-24)26(29,30)31;27-23-9-7-19(8-10-23)21-12-20(18-4-2-1-3-5-18)13-22(14-21)25(33)32-16-17-6-11-24(31-15-17)26(28,29)30;1-17-28-14-23(15-29-17)25(16-31)30-26(32)22-12-20(18-5-3-2-4-6-18)11-21(13-22)19-7-9-24(27)10-8-19;26-23-9-7-19(8-10-23)21-12-20(18-4-2-1-3-5-18)13-22(14-21)25(30)29-16-17-6-11-24(27)28-15-17;24-22-10-8-18(9-11-22)20-12-19(17-4-2-1-3-5-17)13-21(14-20)23(26)25-15-16-6-7-16/h7-18H,2-6H2,1H3,(H,33,34);6-14,16H,1-5,15H2,(H,33,34);6-15,18H,1-5,16H2,(H,32,33);7-15,18,25,31H,2-6,16H2,1H3,(H,30,32);6-15,18H,1-5,16H2,(H,29,30);8-14,16-17H,1-7,15H2,(H,25,26)/t17-;;;25-;;/m1..1../s1
InChIKeyFXKLSIONWWILES-SFZSZEQMSA-N
XLogP42.25
TPSA272.17 Ų
H-Bond Donors7
H-Bond Acceptors13
Rotatable Bonds31
Heavy Atoms189
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002724.57
LogP ≤ 542.25
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide with MolForge

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Related Compounds

8-[2-amino-4-[[6-[1-(4-chloro-3-fluorophenyl)propylcarbamoyl]isoquinolin-3-yl]amino]-4-methyliminobutyl]-N-[1-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]-3-[(2-methyl-4-pyridinyl)amino]isoquinoline-6-carboxamide
CID 123885950
[3-[[2-[2-[2-[[(5-Chloropyridin-2-yl)amino]methyl]-3-methylpiperidine-1-carbonyl]-4-fluorophenyl]pyrimidin-4-yl]methyl]-2-[[[5-(trifluoromethyl)pyrimidin-2-yl]amino]methyl]piperidin-1-yl]-(3-fluoro-2-pyrimidin-2-ylphenyl)methanone
CID 123893427
1-[3-chloro-5-(1-hydroxypropan-2-yl)-2-pyridinyl]-N-(4-methylphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;1-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]benzamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
CID 157225509
N-[(6-chloro-3-pyridinyl)methyl]-3-cyclohexyl-5-(4-methylphenyl)benzamide;N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-3-cyclohexyl-5-(4-methylphenyl)benzamide;3-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]-5-(4-methylphenyl)benzamide;3-cyclohexyl-N-[(2-methoxypyrimidin-5-yl)methyl]-5-(4-methylphenyl)benzamide;3-cyclohexyl-5-(4-methylphenyl)-N-(1-pyrazin-2-ylethyl)benzamide;3-cyclohexyl-5-(4-methylphenyl)-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-cyclohexyl-5-(4-methylphenyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide
CID 157444149
(2R)-4-[3-chloro-5-(1-hydroxypropan-2-yl)-2-pyridinyl]-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;(2R)-4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;1-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)-3,6-dihydro-2H-pyridine-4-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;(2R)-2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]benzamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
CID 157625358
3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methoxypyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-(2-methoxypyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(2-methoxypyrimidin-5-yl)methyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(1-pyrazin-2-ylethyl)benzamide
CID 158027948
3-cyclohexyl-N-(cyclopropylmethyl)-5-(4-methylphenyl)benzamide;3-cyclohexyl-N-[(2S)-1-hydroxypropan-2-yl]-5-(4-methylphenyl)benzamide;3-cyclohexyl-N-[(1S)-2-hydroxy-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]-5-(4-methylphenyl)benzamide;3-cyclohexyl-N-[(1R)-3-hydroxy-1-[6-(trifluoromethyl)-3-pyridinyl]propyl]-5-(4-methylphenyl)benzamide;3-cyclohexyl-N-[(2R)-1-methoxypropan-2-yl]-5-(4-methylphenyl)benzamide;3-cyclohexyl-5-(4-methylphenyl)-N-[(1R)-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-cyclohexyl-5-(4-methylphenyl)-N-[(2-methylpyrimidin-5-yl)methyl]benzamide
CID 158032451
4-chloro-N-[1-[5-(2-methylpyrimidin-4-yl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]ethyl]benzamide;N-[1-[5-[6-(1,1-difluoroethyl)pyrimidin-4-yl]-7,8-dihydro-6H-1,5-naphthyridin-2-yl]ethyl]-4-fluorobenzamide;4-fluoro-N-[1-[5-(2-methylpyrimidin-4-yl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]cyclopropyl]benzamide;4-fluoro-N-[1-[5-(2-methylpyrimidin-4-yl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]ethyl]benzamide;methane
CID 158186055
8-chloro-3-[(1S)-1-[[2-(cyclopropylamino)-5-methylpyrimidin-4-yl]amino]ethyl]-2-phenylisoquinolin-1-one;bis(8-chloro-3-[(1S)-1-[(2,5-dimethylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one);8-chloro-3-[(1S)-1-[(2-ethyl-5-methylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one;8-chloro-3-[(1S)-1-[[4-methyl-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]-2-phenylisoquinolin-1-one;methane
CID 158187992
1-chloro-4-(4-methylpentyl)benzene;N-(4-chlorophenyl)-3-methylbutanamide;N-cyclohexyl-3-methylbutanamide;N-cyclopentyl-3-methylbutanamide;1-(3,5-dimethylpiperazin-1-yl)-3-methylbutan-1-one;N-ethyl-N,3-dimethylbutanamide;N-(4-fluorophenyl)-3-methylbutanamide;4-(3-methylbutanoyl)piperazin-2-one;1-methyl-4-(3-methylbutyl)benzene;2-methyl-5-(3-methylbutyl)pyrimidine;2-methyl-5-(4-methylpentyl)pyridine;bis(4-methyl-1-(6-methyl-3-pyridinyl)pentan-3-one);5-(4-methylpentyl)-2-(trifluoromethyl)pyridine;3-methyl-1-phenylbutan-1-one;3-methyl-1-piperidin-1-ylbutan-1-one;3-methyl-N-propan-2-ylbutanamide;3-methyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N,N,3-trimethylbutanamide
CID 158739781
1-chloro-4-(4-methylpentyl)benzene;N-cyclohexyl-3-methylbutanamide;N-cyclopentyl-3-methylbutanamide;1-(2,3-dimethylbutyl)-4-methylbenzene;1-(2,4-dimethylpentan-2-yl)-4-methylbenzene;N-ethyl-N,4-dimethylpent-1-en-2-amine;N-(4-fluorophenyl)-3-methylbutanamide;1-(4-fluorophenyl)-3-methylbutan-1-one;4-(3-methylbutanoyl)piperazin-2-one;1-methyl-4-(3-methylbutyl)benzene;2-methyl-5-(3-methylbutyl)pyrimidine;2-methyl-5-(4-methylpentyl)pyridine;4-methyl-1-(4-methylphenyl)pentan-3-one;4-methyl-1-(6-methyl-3-pyridinyl)pentan-3-one;5-(4-methylpentyl)-2-(trifluoromethyl)pyridine;3-methyl-1-phenylbutan-1-one;4-methyl-N-propan-2-ylpent-1-en-2-amine
CID 159022390
3-[(1S)-1-[(5-acetyl-2-aminopyrimidin-4-yl)amino]ethyl]-8-chloro-2-cyclopropylisoquinolin-1-one;2-amino-4-[[(1S)-1-(8-chloro-2-cyclopropyl-1-oxoisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;3-[(1S)-1-[(2-amino-5-methylpyrimidin-4-yl)amino]ethyl]-8-chloro-2-cyclopropylisoquinolin-1-one;8-chloro-2-cyclopropyl-3-[(1S)-1-[[4-methyl-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]isoquinolin-1-one;3-[(1S)-1-[(5-chloro-2-methylpyrimidin-4-yl)amino]ethyl]-8-methyl-2-phenylisoquinolin-1-one;sulfane
CID 159093349

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide?
The IUPAC name of 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide (CID 158170733) is 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide is C[C@@H](NC(=O)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1)c1ccc(C(F)(F)F)nc1.Cc1ncc([C@@H](CO)NC(=O)c2cc(-c3ccc(Cl)cc3)cc(C3CCCCC3)c2)cn1.O=C(NCC1CC1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ccc(C(F)(F)F)nc1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ccc(Cl)nc1)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.O=C(NCc1ncc(C(F)(F)F)cc1Cl)c1cc(-c2ccc(Cl)cc2)cc(C2CCCCC2)c1.
What is the InChIKey of 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide?
The InChIKey is FXKLSIONWWILES-SFZSZEQMSA-N. The full InChI is InChI=1S/C27H26ClF3N2O.C26H23Cl2F3N2O.C26H24ClF3N2O.C26H28ClN3O2.C25H24Cl2N2O.C23H26ClNO/c1-17(20-9-12-25(32-16-20)27(29,30)31)33-26(34)23-14-21(18-5-3-2-4-6-18)13-22(15-23)19-7-10-24(28)11-8-19;27-22-8-6-17(7-9-22)19-10-18(16-4-2-1-3-5-16)11-20(12-19)25(34)33-15-24-23(28)13-21(14-32-24)26(29,30)31;27-23-9-7-19(8-10-23)21-12-20(18-4-2-1-3-5-18)13-22(14-21)25(33)32-16-17-6-11-24(31-15-17)26(28,29)30;1-17-28-14-23(15-29-17)25(16-31)30-26(32)22-12-20(18-5-3-2-4-6-18)11-21(13-22)19-7-9-24(27)10-8-19;26-23-9-7-19(8-10-23)21-12-20(18-4-2-1-3-5-18)13-22(14-21)25(30)29-16-17-6-11-24(27)28-15-17;24-22-10-8-18(9-11-22)20-12-19(17-4-2-1-3-5-17)13-21(14-20)23(26)25-15-16-6-7-16/h7-18H,2-6H2,1H3,(H,33,34);6-14,16H,1-5,15H2,(H,33,34);6-15,18H,1-5,16H2,(H,32,33);7-15,18,25,31H,2-6,16H2,1H3,(H,30,32);6-15,18H,1-5,16H2,(H,29,30);8-14,16-17H,1-7,15H2,(H,25,26)/t17-;;;25-;;/m1..1../s1.
What are the key properties of 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide?
3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide has a molecular weight of 2724.57 g/mol, XLogP of 42.25, 31 rotatable bonds, 7 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-[(6-chloro-3-pyridinyl)methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-5-cyclohexylbenzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-(cyclopropylmethyl)benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1S)-2-hydroxy-1-(2-methylpyrimidin-5-yl)ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]benzamide;3-(4-chlorophenyl)-5-cyclohexyl-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]benzamide is sourced from PubChem (CID 158170733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).