2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid

C245H236ClF7N22O16 — CID 161324947

IUPAC2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid
SMILESCC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(CN4CCN(C)CC4)cc3)cn2)c1.CCOc1cccc(-c2ccc(CC(=O)NCc3cccc(C)c3)cn2)c1.CCOc1ccccc1-c1ccc(CC(=O)NCc2cccc(C)c2)cn1.CCc1ccc(-c2ccc(CC(=O)NCc3cccc(C)c3)cn2)cc1.Cc1cccc(CNC(=O)Cc2ccc(-c3ccc(C(=O)O)cc3)nc2)c1.Cc1cccc(CNC(=O)Cc2ccc(-c3ccc(F)cc3)nc2)c1.Cc1cccc(CNC(=O)Cc2ccc(-c3cccc(F)c3)nc2)c1.O=C(Cc1ccc(-c2cccc(Cl)c2)cc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2ccccc2)nc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2ccccn2)cc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2cccnc2)cc1)NCc1cccc(F)c1
InChIInChI=1S/C31H38FN3O2.2C23H24N2O2.C23H24N2O.C22H20N2O3.C21H17ClFNO.2C21H19FN2O.3C20H17FN2O/c1-23(2)22-37-31-17-25(16-28(32)18-31)6-11-30(36)19-29-10-9-27(20-33-29)26-7-4-24(5-8-26)21-35-14-12-34(3)13-15-35;1-3-27-21-9-5-8-20(14-21)22-11-10-19(15-24-22)13-23(26)25-16-18-7-4-6-17(2)12-18;1-3-27-22-10-5-4-9-20(22)21-12-11-19(15-24-21)14-23(26)25-16-18-8-6-7-17(2)13-18;1-3-18-7-10-21(11-8-18)22-12-9-20(15-24-22)14-23(26)25-16-19-6-4-5-17(2)13-19;1-15-3-2-4-16(11-15)14-24-21(25)12-17-5-10-20(23-13-17)18-6-8-19(9-7-18)22(26)27;22-19-5-2-4-18(13-19)17-9-7-15(8-10-17)12-21(25)24-14-16-3-1-6-20(23)11-16;1-15-4-2-5-16(10-15)14-24-21(25)11-17-8-9-20(23-13-17)18-6-3-7-19(22)12-18;1-15-3-2-4-16(11-15)14-24-21(25)12-17-5-10-20(23-13-17)18-6-8-19(22)9-7-18;21-19-5-1-3-16(11-19)13-23-20(24)12-15-6-8-17(9-7-15)18-4-2-10-22-14-18;21-18-5-3-4-16(12-18)14-23-20(24)13-15-7-9-17(10-8-15)19-6-1-2-11-22-19;21-18-8-4-5-15(11-18)14-23-20(24)12-16-9-10-19(22-13-16)17-6-2-1-3-7-17/h4-5,7-10,16-18,20,23H,6,11-15,19,21-22H2,1-3H3;4-12,14-15H,3,13,16H2,1-2H3,(H,25,26);4-13,15H,3,14,16H2,1-2H3,(H,25,26);4-13,15H,3,14,16H2,1-2H3,(H,25,26);2-11,13H,12,14H2,1H3,(H,24,25)(H,26,27);1-11,13H,12,14H2,(H,24,25);2-10,12-13H,11,14H2,1H3,(H,24,25);2-11,13H,12,14H2,1H3,(H,24,25);1-11,14H,12-13H2,(H,23,24);1-12H,13-14H2,(H,23,24);1-11,13H,12,14H2,(H,23,24)
InChIKeyVKQKDTGIGZCSHA-UHFFFAOYSA-N
MW3913.16 g/mol
LogP46.49
Rot. Bonds67

About 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid

2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid (PubChem CID 161324947) has the molecular formula C245H236ClF7N22O16 and a molecular weight of 3913.16 g/mol. Its IUPAC name is 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid.

Molecular Properties

Compound Name2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid
PubChem CID161324947
Molecular FormulaC245H236ClF7N22O16
Molecular Weight3913.16 g/mol
Exact Mass3909.79
IUPAC Name2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid
SMILESCC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(CN4CCN(C)CC4)cc3)cn2)c1.CCOc1cccc(-c2ccc(CC(=O)NCc3cccc(C)c3)cn2)c1.CCOc1ccccc1-c1ccc(CC(=O)NCc2cccc(C)c2)cn1.CCc1ccc(-c2ccc(CC(=O)NCc3cccc(C)c3)cn2)cc1.Cc1cccc(CNC(=O)Cc2ccc(-c3ccc(C(=O)O)cc3)nc2)c1.Cc1cccc(CNC(=O)Cc2ccc(-c3ccc(F)cc3)nc2)c1.Cc1cccc(CNC(=O)Cc2ccc(-c3cccc(F)c3)nc2)c1.O=C(Cc1ccc(-c2cccc(Cl)c2)cc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2ccccc2)nc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2ccccn2)cc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2cccnc2)cc1)NCc1cccc(F)c1
InChIInChI=1S/C31H38FN3O2.2C23H24N2O2.C23H24N2O.C22H20N2O3.C21H17ClFNO.2C21H19FN2O.3C20H17FN2O/c1-23(2)22-37-31-17-25(16-28(32)18-31)6-11-30(36)19-29-10-9-27(20-33-29)26-7-4-24(5-8-26)21-35-14-12-34(3)13-15-35;1-3-27-21-9-5-8-20(14-21)22-11-10-19(15-24-22)13-23(26)25-16-18-7-4-6-17(2)12-18;1-3-27-22-10-5-4-9-20(22)21-12-11-19(15-24-21)14-23(26)25-16-18-8-6-7-17(2)13-18;1-3-18-7-10-21(11-8-18)22-12-9-20(15-24-22)14-23(26)25-16-19-6-4-5-17(2)13-19;1-15-3-2-4-16(11-15)14-24-21(25)12-17-5-10-20(23-13-17)18-6-8-19(9-7-18)22(26)27;22-19-5-2-4-18(13-19)17-9-7-15(8-10-17)12-21(25)24-14-16-3-1-6-20(23)11-16;1-15-4-2-5-16(10-15)14-24-21(25)11-17-8-9-20(23-13-17)18-6-3-7-19(22)12-18;1-15-3-2-4-16(11-15)14-24-21(25)12-17-5-10-20(23-13-17)18-6-8-19(22)9-7-18;21-19-5-1-3-16(11-19)13-23-20(24)12-15-6-8-17(9-7-15)18-4-2-10-22-14-18;21-18-5-3-4-16(12-18)14-23-20(24)13-15-7-9-17(10-8-15)19-6-1-2-11-22-19;21-18-8-4-5-15(11-18)14-23-20(24)12-16-9-10-19(22-13-16)17-6-2-1-3-7-17/h4-5,7-10,16-18,20,23H,6,11-15,19,21-22H2,1-3H3;4-12,14-15H,3,13,16H2,1-2H3,(H,25,26);4-13,15H,3,14,16H2,1-2H3,(H,25,26);4-13,15H,3,14,16H2,1-2H3,(H,25,26);2-11,13H,12,14H2,1H3,(H,24,25)(H,26,27);1-11,13H,12,14H2,(H,24,25);2-10,12-13H,11,14H2,1H3,(H,24,25);2-11,13H,12,14H2,1H3,(H,24,25);1-11,14H,12-13H2,(H,23,24);1-12H,13-14H2,(H,23,24);1-11,13H,12,14H2,(H,23,24)
InChIKeyVKQKDTGIGZCSHA-UHFFFAOYSA-N
XLogP46.49
TPSA508.44 Ų
H-Bond Donors11
H-Bond Acceptors27
Rotatable Bonds67
Heavy Atoms291
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003913.16
LogP ≤ 546.49
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1027

Analyze 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid with MolForge

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Related Compounds

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-(3-chlorophenyl)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethyl]-4-fluoro-3-(trifluoromethyl)benzamide;2-[3-[(1S)-1-(5-chloro-2-pyridinyl)-1-[[3-(1,1-difluoroethyl)-4-fluorobenzoyl]amino]-2-phenylethyl]-5-fluorophenoxy]acetic acid;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-(3-fluoro-5-hydroxyphenyl)-2-phenylethyl]-3-(1,1-difluoroethyl)-4-fluorobenzamide;N-[(1S)-1-(5-chloro-2-pyridinyl)-1-(3-fluoro-5-methoxyphenyl)-2-phenylethyl]-3-(1,1-difluoroethyl)-4-fluorobenzamide;N-[(1R)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(3-methylphenyl)ethyl]-4-fluoro-3-(trifluoromethyl)benzamide
CID 123365881
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
(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
(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
3-[2-[7-(2-chlorophenyl)-3,4-dihydro-2H-chromen-4-yl]ethyl]pyridine-4-carboxylic acid;3-[2-(6-ethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-fluoro-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]pyridine-4-carboxylic acid;3-[2-[7-(3-fluoro-2-methylphenyl)-3,4-dihydro-2H-chromen-4-yl]ethyl]pyridine-4-carboxylic acid;3-[2-(6-methoxy-5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methoxy-7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]pyridine-4-carboxylic acid;3-[2-[6-[2-(trifluoromethyl)phenoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]ethyl]pyridine-4-carboxylic acid
CID 157187986
cumene;N,N-dimethyl-4-propan-2-ylbenzamide;1,4-di(propan-2-yl)-1,4-diazepane;ethyl 4-propan-2-ylbenzoate;1-fluoro-2-propan-2-ylbenzene;1-(2-methoxyethoxy)-4-propan-2-yl-2-(trifluoromethyl)benzene;1-methoxy-2-propan-2-ylbenzene;4-methoxy-2-propan-2-ylpyridine;(4-methylpiperazin-1-yl)-(4-propan-2-ylphenyl)methanone;1-methyl-2-propan-2-ylbenzene;morpholin-4-yl-(4-propan-2-ylphenyl)methanone;2-propan-2-ylazetidine;3-propan-2-ylbenzoic acid;4-propan-2-ylbenzoic acid;2-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 157438131
5-[2-[3-(1,1-difluoroethyl)-5-fluorophenoxy]ethyl]-N-(2-methylbutyl)pyridine-2-carboxamide;5-[[2-(1,1-difluoroethyl)phenyl]methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenoxy]ethyl]-N-(2-methylpropyl)pyridine-2-carboxamide;5-[(3-fluoro-4-methylphenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[(3-fluorophenyl)methoxymethyl]-N-(oxan-4-ylmethyl)pyridine-2-carboxamide;5-[2-[3-fluoro-5-(trifluoromethyl)phenoxy]ethyl]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 157907869
CID 158067790
CID 158067790

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid?
The IUPAC name of 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid (CID 161324947) is 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid.
What is the SMILES notation for 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid?
The canonical SMILES for 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid is CC(C)COc1cc(F)cc(CCC(=O)Cc2ccc(-c3ccc(CN4CCN(C)CC4)cc3)cn2)c1.CCOc1cccc(-c2ccc(CC(=O)NCc3cccc(C)c3)cn2)c1.CCOc1ccccc1-c1ccc(CC(=O)NCc2cccc(C)c2)cn1.CCc1ccc(-c2ccc(CC(=O)NCc3cccc(C)c3)cn2)cc1.Cc1cccc(CNC(=O)Cc2ccc(-c3ccc(C(=O)O)cc3)nc2)c1.Cc1cccc(CNC(=O)Cc2ccc(-c3ccc(F)cc3)nc2)c1.Cc1cccc(CNC(=O)Cc2ccc(-c3cccc(F)c3)nc2)c1.O=C(Cc1ccc(-c2cccc(Cl)c2)cc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2ccccc2)nc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2ccccn2)cc1)NCc1cccc(F)c1.O=C(Cc1ccc(-c2cccnc2)cc1)NCc1cccc(F)c1.
What is the InChIKey of 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid?
The InChIKey is VKQKDTGIGZCSHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H38FN3O2.2C23H24N2O2.C23H24N2O.C22H20N2O3.C21H17ClFNO.2C21H19FN2O.3C20H17FN2O/c1-23(2)22-37-31-17-25(16-28(32)18-31)6-11-30(36)19-29-10-9-27(20-33-29)26-7-4-24(5-8-26)21-35-14-12-34(3)13-15-35;1-3-27-21-9-5-8-20(14-21)22-11-10-19(15-24-22)13-23(26)25-16-18-7-4-6-17(2)12-18;1-3-27-22-10-5-4-9-20(22)21-12-11-19(15-24-21)14-23(26)25-16-18-8-6-7-17(2)13-18;1-3-18-7-10-21(11-8-18)22-12-9-20(15-24-22)14-23(26)25-16-19-6-4-5-17(2)13-19;1-15-3-2-4-16(11-15)14-24-21(25)12-17-5-10-20(23-13-17)18-6-8-19(9-7-18)22(26)27;22-19-5-2-4-18(13-19)17-9-7-15(8-10-17)12-21(25)24-14-16-3-1-6-20(23)11-16;1-15-4-2-5-16(10-15)14-24-21(25)11-17-8-9-20(23-13-17)18-6-3-7-19(22)12-18;1-15-3-2-4-16(11-15)14-24-21(25)12-17-5-10-20(23-13-17)18-6-8-19(22)9-7-18;21-19-5-1-3-16(11-19)13-23-20(24)12-15-6-8-17(9-7-15)18-4-2-10-22-14-18;21-18-5-3-4-16(12-18)14-23-20(24)13-15-7-9-17(10-8-15)19-6-1-2-11-22-19;21-18-8-4-5-15(11-18)14-23-20(24)12-16-9-10-19(22-13-16)17-6-2-1-3-7-17/h4-5,7-10,16-18,20,23H,6,11-15,19,21-22H2,1-3H3;4-12,14-15H,3,13,16H2,1-2H3,(H,25,26);4-13,15H,3,14,16H2,1-2H3,(H,25,26);4-13,15H,3,14,16H2,1-2H3,(H,25,26);2-11,13H,12,14H2,1H3,(H,24,25)(H,26,27);1-11,13H,12,14H2,(H,24,25);2-10,12-13H,11,14H2,1H3,(H,24,25);2-11,13H,12,14H2,1H3,(H,24,25);1-11,14H,12-13H2,(H,23,24);1-12H,13-14H2,(H,23,24);1-11,13H,12,14H2,(H,23,24).
What are the key properties of 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid?
2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid has a molecular weight of 3913.16 g/mol, XLogP of 46.49, 67 rotatable bonds, 11 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-chlorophenyl)phenyl]-N-[(3-fluorophenyl)methyl]acetamide;2-[6-(2-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(3-ethoxyphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-ethylphenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[3-fluoro-5-(2-methylpropoxy)phenyl]-1-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-2-pyridinyl]butan-2-one;N-[(3-fluorophenyl)methyl]-2-(6-phenyl-3-pyridinyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-2-ylphenyl)acetamide;N-[(3-fluorophenyl)methyl]-2-(4-pyridin-3-ylphenyl)acetamide;2-[6-(3-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;2-[6-(4-fluorophenyl)-3-pyridinyl]-N-[(3-methylphenyl)methyl]acetamide;4-[5-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]-2-pyridinyl]benzoic acid is sourced from PubChem (CID 161324947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).