3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide

C176H184ClF13N14O9 — CID 164963467

IUPAC3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide
SMILESCCCNC(=O)c1cccc(Cc2cc(Cc3cc(C)cc(C(F)(F)F)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3cc(F)cc(Cl)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccc(C)cc3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccc(C)cc3C(F)(F)F)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3cccc(C(F)(F)F)c3)ccn2)c1OC.CCCNC(=O)c1cccc(Cc2cc(Cc3cccc(OC)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccccc3C(F)(F)F)ccn2)c1C
InChIInChI=1S/2C26H27F3N2O.C25H25F3N2O2.C25H25F3N2O.C25H28N2O2.C25H28N2O.C24H24ClFN2O/c1-4-11-31-25(32)23-7-5-6-20(18(23)3)16-22-15-19(10-12-30-22)14-21-9-8-17(2)13-24(21)26(27,28)29;1-4-9-31-25(32)24-7-5-6-21(18(24)3)16-23-15-19(8-10-30-23)13-20-11-17(2)12-22(14-20)26(27,28)29;1-3-11-30-24(31)22-9-5-7-19(23(22)32-2)16-21-15-18(10-12-29-21)13-17-6-4-8-20(14-17)25(26,27)28;1-3-12-30-24(31)22-9-6-8-19(17(22)2)16-21-15-18(11-13-29-21)14-20-7-4-5-10-23(20)25(26,27)28;1-4-12-27-25(28)24-10-6-8-21(18(24)2)17-22-15-20(11-13-26-22)14-19-7-5-9-23(16-19)29-3;1-4-13-27-25(28)24-7-5-6-22(19(24)3)17-23-16-21(12-14-26-23)15-20-10-8-18(2)9-11-20;1-3-8-28-24(29)23-6-4-5-19(16(23)2)14-22-13-17(7-9-27-22)10-18-11-20(25)15-21(26)12-18/h5-10,12-13,15H,4,11,14,16H2,1-3H3,(H,31,32);5-8,10-12,14-15H,4,9,13,16H2,1-3H3,(H,31,32);4-10,12,14-15H,3,11,13,16H2,1-2H3,(H,30,31);4-11,13,15H,3,12,14,16H2,1-2H3,(H,30,31);5-11,13,15-16H,4,12,14,17H2,1-3H3,(H,27,28);5-12,14,16H,4,13,15,17H2,1-3H3,(H,27,28);4-7,9,11-13,15H,3,8,10,14H2,1-2H3,(H,28,29)
InChIKeyCDOWVPQIMODFKK-UHFFFAOYSA-N
MW2921.92 g/mol
LogP38.48
Rot. Bonds51

About 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide

3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide (PubChem CID 164963467) has the molecular formula C176H184ClF13N14O9 and a molecular weight of 2921.92 g/mol. Its IUPAC name is 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide.

Molecular Properties

Compound Name3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide
PubChem CID164963467
Molecular FormulaC176H184ClF13N14O9
Molecular Weight2921.92 g/mol
Exact Mass2919.39
IUPAC Name3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide
SMILESCCCNC(=O)c1cccc(Cc2cc(Cc3cc(C)cc(C(F)(F)F)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3cc(F)cc(Cl)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccc(C)cc3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccc(C)cc3C(F)(F)F)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3cccc(C(F)(F)F)c3)ccn2)c1OC.CCCNC(=O)c1cccc(Cc2cc(Cc3cccc(OC)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccccc3C(F)(F)F)ccn2)c1C
InChIInChI=1S/2C26H27F3N2O.C25H25F3N2O2.C25H25F3N2O.C25H28N2O2.C25H28N2O.C24H24ClFN2O/c1-4-11-31-25(32)23-7-5-6-20(18(23)3)16-22-15-19(10-12-30-22)14-21-9-8-17(2)13-24(21)26(27,28)29;1-4-9-31-25(32)24-7-5-6-21(18(24)3)16-23-15-19(8-10-30-23)13-20-11-17(2)12-22(14-20)26(27,28)29;1-3-11-30-24(31)22-9-5-7-19(23(22)32-2)16-21-15-18(10-12-29-21)13-17-6-4-8-20(14-17)25(26,27)28;1-3-12-30-24(31)22-9-6-8-19(17(22)2)16-21-15-18(11-13-29-21)14-20-7-4-5-10-23(20)25(26,27)28;1-4-12-27-25(28)24-10-6-8-21(18(24)2)17-22-15-20(11-13-26-22)14-19-7-5-9-23(16-19)29-3;1-4-13-27-25(28)24-7-5-6-22(19(24)3)17-23-16-21(12-14-26-23)15-20-10-8-18(2)9-11-20;1-3-8-28-24(29)23-6-4-5-19(16(23)2)14-22-13-17(7-9-27-22)10-18-11-20(25)15-21(26)12-18/h5-10,12-13,15H,4,11,14,16H2,1-3H3,(H,31,32);5-8,10-12,14-15H,4,9,13,16H2,1-3H3,(H,31,32);4-10,12,14-15H,3,11,13,16H2,1-2H3,(H,30,31);4-11,13,15H,3,12,14,16H2,1-2H3,(H,30,31);5-11,13,15-16H,4,12,14,17H2,1-3H3,(H,27,28);5-12,14,16H,4,13,15,17H2,1-3H3,(H,27,28);4-7,9,11-13,15H,3,8,10,14H2,1-2H3,(H,28,29)
InChIKeyCDOWVPQIMODFKK-UHFFFAOYSA-N
XLogP38.48
TPSA312.39 Ų
H-Bond Donors7
H-Bond Acceptors16
Rotatable Bonds51
Heavy Atoms213
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002921.92
LogP ≤ 538.48
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1016

Analyze 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide with MolForge

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Launch Full Analysis

Related Compounds

1-[4-[[4-[4-[3-[5-[[(1-Acetylpiperidin-4-yl)amino]methyl]-6-methoxy-2-pyridinyl]-2-(trifluoromethyl)phenyl]-3-chloro-2-pyridinyl]-2-methoxyphenyl]methylamino]piperidin-1-yl]ethanone
CID 170696367
tert-butyl 2-[3-[(1S)-1-(5-chloro-2-pyridinyl)-1-[[3-(1,1-difluoroethyl)-4-fluorobenzoyl]amino]-2-phenylethyl]-5-fluorophenoxy]acetate;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-(difluoromethoxy)-5-fluorophenyl]-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-(3-ethoxy-5-fluorophenyl)-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethyl]-3-(1,1-difluoroethyl)-4-fluorobenzamide
CID 123175383
N-[(1R)-2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-cyanophenyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(2-methoxyphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 123630379
N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-[2-(4-oxopentyl)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-[3-(4-oxopentyl)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 123655255
N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(2-methoxyphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenylethyl]-3-(1,1-difluoroethyl)-4-fluorobenzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]-2-phenylethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 123665839
N-(4-chloro-3-pyridin-2-ylphenyl)-2,6-dimethyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methoxy-5-methylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 123818813
(3R)-3-(5-chloro-2-pyridinyl)-1-[3-(1,1-difluoroethyl)-4-fluorophenyl]-3-[2-fluoro-3-(trifluoromethyl)phenyl]-4-phenylbutan-1-one;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[4-methoxy-3-(trifluoromethyl)phenyl]-2-phenylethyl]-3-(1,1-difluoroethyl)-4-fluorobenzamide
CID 123822346
N-[(1R)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-2-(3-fluoro-4-methylphenyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-(4-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 123873865
6-[4-[(2S)-2-(5-chloro-2-pyridinyl)-2-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-[[4-methyl-3-(trifluoromethyl)benzoyl]amino]ethyl]phenyl]hexanoic acid;3-[4-[(2S)-2-(5-chloro-2-pyridinyl)-2-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-[[4-methyl-3-(trifluoromethyl)benzoyl]amino]ethyl]phenyl]propanoic acid;(E)-3-[4-[(2S)-2-(5-chloro-2-pyridinyl)-2-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-[[4-methyl-3-(trifluoromethyl)benzoyl]amino]ethyl]phenyl]prop-2-enoic acid
CID 123897338
3-(5-chloro-2-pyridinyl)-3-[3-(2,2-difluoropropoxy)-5-fluorophenyl]-1-[4-fluoro-3-(trifluoromethyl)phenyl]-4-phenylbutan-1-one;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;3-(5-chloro-2-pyridinyl)-1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]-4-phenylbutan-1-one
CID 123947560
N-[(1S)-1-[4-(5-chloro-2-pyridinyl)-3-[3-fluoro-5-(trifluoromethyl)phenyl]-2-methoxyphenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 140517013
(3S)-3-(5-chloro-2-pyridinyl)-1-[3-(1,1-difluoroethyl)-4-fluorophenyl]-3-[2-fluoro-3-(trifluoromethyl)phenyl]-4-phenylbutan-1-one;N-[1-(5-chloro-2-pyridinyl)-1-[5-(1,1-difluoroethyl)-2-fluorophenyl]-2-phenylethyl]-4-fluoro-3-(trifluoromethyl)benzamide;3-(5-chloro-2-pyridinyl)-3-[3-(2,2-difluoropropoxy)-5-fluorophenyl]-1-[4-fluoro-3-(trifluoromethyl)phenyl]-4-phenylbutan-1-one;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]-4-methyl-3-(trifluoromethyl)benzamide;3-(5-chloro-2-pyridinyl)-1-[4-fluoro-3-(trifluoromethyl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]-4-phenylbutan-1-one
CID 157165887

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide?
The IUPAC name of 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide (CID 164963467) is 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide.
What is the SMILES notation for 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide?
The canonical SMILES for 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide is CCCNC(=O)c1cccc(Cc2cc(Cc3cc(C)cc(C(F)(F)F)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3cc(F)cc(Cl)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccc(C)cc3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccc(C)cc3C(F)(F)F)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3cccc(C(F)(F)F)c3)ccn2)c1OC.CCCNC(=O)c1cccc(Cc2cc(Cc3cccc(OC)c3)ccn2)c1C.CCCNC(=O)c1cccc(Cc2cc(Cc3ccccc3C(F)(F)F)ccn2)c1C.
What is the InChIKey of 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide?
The InChIKey is CDOWVPQIMODFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H27F3N2O.C25H25F3N2O2.C25H25F3N2O.C25H28N2O2.C25H28N2O.C24H24ClFN2O/c1-4-11-31-25(32)23-7-5-6-20(18(23)3)16-22-15-19(10-12-30-22)14-21-9-8-17(2)13-24(21)26(27,28)29;1-4-9-31-25(32)24-7-5-6-21(18(24)3)16-23-15-19(8-10-30-23)13-20-11-17(2)12-22(14-20)26(27,28)29;1-3-11-30-24(31)22-9-5-7-19(23(22)32-2)16-21-15-18(10-12-29-21)13-17-6-4-8-20(14-17)25(26,27)28;1-3-12-30-24(31)22-9-6-8-19(17(22)2)16-21-15-18(11-13-29-21)14-20-7-4-5-10-23(20)25(26,27)28;1-4-12-27-25(28)24-10-6-8-21(18(24)2)17-22-15-20(11-13-26-22)14-19-7-5-9-23(16-19)29-3;1-4-13-27-25(28)24-7-5-6-22(19(24)3)17-23-16-21(12-14-26-23)15-20-10-8-18(2)9-11-20;1-3-8-28-24(29)23-6-4-5-19(16(23)2)14-22-13-17(7-9-27-22)10-18-11-20(25)15-21(26)12-18/h5-10,12-13,15H,4,11,14,16H2,1-3H3,(H,31,32);5-8,10-12,14-15H,4,9,13,16H2,1-3H3,(H,31,32);4-10,12,14-15H,3,11,13,16H2,1-2H3,(H,30,31);4-11,13,15H,3,12,14,16H2,1-2H3,(H,30,31);5-11,13,15-16H,4,12,14,17H2,1-3H3,(H,27,28);5-12,14,16H,4,13,15,17H2,1-3H3,(H,27,28);4-7,9,11-13,15H,3,8,10,14H2,1-2H3,(H,28,29).
What are the key properties of 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide?
3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide has a molecular weight of 2921.92 g/mol, XLogP of 38.48, 51 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-[(3-chloro-5-fluorophenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;3-[[4-[(3-methoxyphenyl)methyl]-2-pyridinyl]methyl]-2-methyl-N-propylbenzamide;2-methoxy-N-propyl-3-[[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide;2-methyl-3-[[4-[(4-methylphenyl)methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-3-[[4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]-N-propylbenzamide;2-methyl-N-propyl-3-[[4-[[2-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]methyl]benzamide is sourced from PubChem (CID 164963467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).