4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide

C273H320ClF15N38O24 — CID 157144846

IUPAC4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
SMILESCC(C)CCNC(=O)c1ccc(Cc2ccc(OC(F)(F)F)cc2)cc1.CC(C)CCNC(=O)c1ccc(Cc2cccc(OC(F)(F)F)c2)cc1.CC(C)CCNC(=O)c1ccc(Cc2ccccc2OC(F)(F)F)cc1.CCN(CC)CCNC(=O)c1ccc(Nc2ccc(OC)cc2)cc1.CCN(CC)Cc1cn(-c2ccc(Nc3ccc(OC(F)(F)F)cc3)cc2)nn1.CCN(CC)Cc1cn(-c2ccc(Nc3ccc(OC)cc3)cc2)nn1.CCN(CC)Cc1cn(-c2ccc(Nc3cccc(OC)c3)cc2)nn1.COc1ccc(Cc2ccc(C(=O)NCCC(C)C)cc2)cc1.COc1ccc(Nc2ccc(-c3ncc(Cl)[nH]3)cc2C)cc1.COc1ccc(Nc2ccc(-n3cc(CCCO)nn3)cc2)cc1.COc1ccc(Nc2ccc(C(=O)NCCCN(C)C)cc2)cc1.COc1cccc(Cc2ccc(C(=O)NCCC(C)C)cc2)c1.COc1cccc(Nc2ccc(-n3cc(CCCO)nn3)cc2)c1.Cc1cc(C(=O)NCCC(C)C)ccc1Cc1ccccc1OC(F)(F)F
InChIInChI=1S/C21H24F3NO2.C20H22F3N5O.3C20H22F3NO2.2C20H25N5O.C20H27N3O2.2C20H25NO2.C19H25N3O2.2C18H20N4O2.C17H16ClN3O/c1-14(2)10-11-25-20(26)18-9-8-16(15(3)12-18)13-17-6-4-5-7-19(17)27-21(22,23)24;1-3-27(4-2)13-17-14-28(26-25-17)18-9-5-15(6-10-18)24-16-7-11-19(12-8-16)29-20(21,22)23;1-14(2)11-12-24-19(25)17-7-3-15(4-8-17)13-16-5-9-18(10-6-16)26-20(21,22)23;1-14(2)10-11-24-19(25)17-8-6-15(7-9-17)12-16-4-3-5-18(13-16)26-20(21,22)23;1-14(2)11-12-24-19(25)16-9-7-15(8-10-16)13-17-5-3-4-6-18(17)26-20(21,22)23;1-4-24(5-2)14-18-15-25(23-22-18)19-10-6-16(7-11-19)21-17-8-12-20(26-3)13-9-17;1-4-24(5-2)14-18-15-25(23-22-18)19-11-9-16(10-12-19)21-17-7-6-8-20(13-17)26-3;1-4-23(5-2)15-14-21-20(24)16-6-8-17(9-7-16)22-18-10-12-19(25-3)13-11-18;1-15(2)12-13-21-20(22)18-8-4-16(5-9-18)14-17-6-10-19(23-3)11-7-17;1-15(2)11-12-21-20(22)18-9-7-16(8-10-18)13-17-5-4-6-19(14-17)23-3;1-22(2)14-4-13-20-19(23)15-5-7-16(8-6-15)21-17-9-11-18(24-3)12-10-17;1-24-18-6-2-4-15(12-18)19-14-7-9-17(10-8-14)22-13-16(20-21-22)5-3-11-23;1-24-18-10-6-15(7-11-18)19-14-4-8-17(9-5-14)22-13-16(20-21-22)3-2-12-23;1-11-9-12(17-19-10-16(18)21-17)3-8-15(11)20-13-4-6-14(22-2)7-5-13/h4-9,12,14H,10-11,13H2,1-3H3,(H,25,26);5-12,14,24H,3-4,13H2,1-2H3;3-10,14H,11-13H2,1-2H3,(H,24,25);3-9,13-14H,10-12H2,1-2H3,(H,24,25);3-10,14H,11-13H2,1-2H3,(H,24,25);2*6-13,15,21H,4-5,14H2,1-3H3;6-13,22H,4-5,14-15H2,1-3H3,(H,21,24);4-11,15H,12-14H2,1-3H3,(H,21,22);4-10,14-15H,11-13H2,1-3H3,(H,21,22);5-12,21H,4,13-14H2,1-3H3,(H,20,23);2,4,6-10,12-13,19,23H,3,5,11H2,1H3;4-11,13,19,23H,2-3,12H2,1H3;3-10,20H,1-2H3,(H,19,21)
InChIKeyAKOYPPHFFOHPOE-UHFFFAOYSA-N
MW4838.23 g/mol
LogP58.02
Rot. Bonds101

About 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide

4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide (PubChem CID 157144846) has the molecular formula C273H320ClF15N38O24 and a molecular weight of 4838.23 g/mol. Its IUPAC name is 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
PubChem CID157144846
Molecular FormulaC273H320ClF15N38O24
Molecular Weight4838.23 g/mol
Exact Mass4834.44
IUPAC Name4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
SMILESCC(C)CCNC(=O)c1ccc(Cc2ccc(OC(F)(F)F)cc2)cc1.CC(C)CCNC(=O)c1ccc(Cc2cccc(OC(F)(F)F)c2)cc1.CC(C)CCNC(=O)c1ccc(Cc2ccccc2OC(F)(F)F)cc1.CCN(CC)CCNC(=O)c1ccc(Nc2ccc(OC)cc2)cc1.CCN(CC)Cc1cn(-c2ccc(Nc3ccc(OC(F)(F)F)cc3)cc2)nn1.CCN(CC)Cc1cn(-c2ccc(Nc3ccc(OC)cc3)cc2)nn1.CCN(CC)Cc1cn(-c2ccc(Nc3cccc(OC)c3)cc2)nn1.COc1ccc(Cc2ccc(C(=O)NCCC(C)C)cc2)cc1.COc1ccc(Nc2ccc(-c3ncc(Cl)[nH]3)cc2C)cc1.COc1ccc(Nc2ccc(-n3cc(CCCO)nn3)cc2)cc1.COc1ccc(Nc2ccc(C(=O)NCCCN(C)C)cc2)cc1.COc1cccc(Cc2ccc(C(=O)NCCC(C)C)cc2)c1.COc1cccc(Nc2ccc(-n3cc(CCCO)nn3)cc2)c1.Cc1cc(C(=O)NCCC(C)C)ccc1Cc1ccccc1OC(F)(F)F
InChIInChI=1S/C21H24F3NO2.C20H22F3N5O.3C20H22F3NO2.2C20H25N5O.C20H27N3O2.2C20H25NO2.C19H25N3O2.2C18H20N4O2.C17H16ClN3O/c1-14(2)10-11-25-20(26)18-9-8-16(15(3)12-18)13-17-6-4-5-7-19(17)27-21(22,23)24;1-3-27(4-2)13-17-14-28(26-25-17)18-9-5-15(6-10-18)24-16-7-11-19(12-8-16)29-20(21,22)23;1-14(2)11-12-24-19(25)17-7-3-15(4-8-17)13-16-5-9-18(10-6-16)26-20(21,22)23;1-14(2)10-11-24-19(25)17-8-6-15(7-9-17)12-16-4-3-5-18(13-16)26-20(21,22)23;1-14(2)11-12-24-19(25)16-9-7-15(8-10-16)13-17-5-3-4-6-18(17)26-20(21,22)23;1-4-24(5-2)14-18-15-25(23-22-18)19-10-6-16(7-11-19)21-17-8-12-20(26-3)13-9-17;1-4-24(5-2)14-18-15-25(23-22-18)19-11-9-16(10-12-19)21-17-7-6-8-20(13-17)26-3;1-4-23(5-2)15-14-21-20(24)16-6-8-17(9-7-16)22-18-10-12-19(25-3)13-11-18;1-15(2)12-13-21-20(22)18-8-4-16(5-9-18)14-17-6-10-19(23-3)11-7-17;1-15(2)11-12-21-20(22)18-9-7-16(8-10-18)13-17-5-4-6-19(14-17)23-3;1-22(2)14-4-13-20-19(23)15-5-7-16(8-6-15)21-17-9-11-18(24-3)12-10-17;1-24-18-6-2-4-15(12-18)19-14-7-9-17(10-8-14)22-13-16(20-21-22)5-3-11-23;1-24-18-10-6-15(7-11-18)19-14-4-8-17(9-5-14)22-13-16(20-21-22)3-2-12-23;1-11-9-12(17-19-10-16(18)21-17)3-8-15(11)20-13-4-6-14(22-2)7-5-13/h4-9,12,14H,10-11,13H2,1-3H3,(H,25,26);5-12,14,24H,3-4,13H2,1-2H3;3-10,14H,11-13H2,1-2H3,(H,24,25);3-9,13-14H,10-12H2,1-2H3,(H,24,25);3-10,14H,11-13H2,1-2H3,(H,24,25);2*6-13,15,21H,4-5,14H2,1-3H3;6-13,22H,4-5,14-15H2,1-3H3,(H,21,24);4-11,15H,12-14H2,1-3H3,(H,21,22);4-10,14-15H,11-13H2,1-3H3,(H,21,22);5-12,21H,4,13-14H2,1-3H3,(H,20,23);2,4,6-10,12-13,19,23H,3,5,11H2,1H3;4-11,13,19,23H,2-3,12H2,1H3;3-10,20H,1-2H3,(H,19,21)
InChIKeyAKOYPPHFFOHPOE-UHFFFAOYSA-N
XLogP58.02
TPSA697.15 Ų
H-Bond Donors19
H-Bond Acceptors53
Rotatable Bonds101
Heavy Atoms351
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004838.23
LogP ≤ 558.02
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1053

Analyze 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide with MolForge

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Related Compounds

4-benzyl-N-[3-(diethylamino)propyl]-3-methylbenzamide;N-[4-[[3-[4-(diethylaminomethyl)triazol-1-yl]anilino]methyl]phenyl]-3-methoxybenzamide;N-[4-[4-[4-(diethylaminomethyl)triazol-1-yl]anilino]phenyl]-3-methoxybenzamide;N-[3-[3-[5-(diethylamino)pentanoyl]anilino]phenyl]-3-methoxybenzamide;N-[3-(diethylamino)propyl]-4-[3-[(3-methoxybenzoyl)amino]anilino]-3-methylbenzamide;N-[3-(diethylamino)propyl]-3-methyl-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-[2-(dimethylamino)ethyl]-4-[(3-methoxyphenyl)methyl]-3-methylbenzamide;N-[3-[4-[4-(3-hydroxypropyl)triazol-1-yl]anilino]phenyl]-3-methoxybenzamide;N-[4-[4-[4-(3-hydroxypropyl)triazol-1-yl]anilino]phenyl]-3-methoxybenzamide;N-(3-imidazol-1-ylpropyl)-4-[(3-methoxyphenyl)methyl]benzamide;N-(3-imidazol-1-ylpropyl)-4-[(3-methoxyphenyl)methyl]-3-methylbenzamide;3-methyl-N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide
CID 157731073
2-[3-[[4-(4-chloro-3H-pyrrol-2-yl)-2-methylphenyl]methyl]phenyl]-1-(3-methoxyphenyl)ethanone;N-[4-[3-[4-(diethylaminomethyl)triazol-1-yl]anilino]phenyl]benzamide;N-[4-[3-[4-(diethylaminomethyl)triazol-1-yl]anilino]phenyl]-2-methoxybenzamide;N-[4-[3-[4-(diethylaminomethyl)triazol-1-yl]anilino]phenyl]-3-methoxybenzamide;N-[4-[3-[4-(diethylaminomethyl)triazol-1-yl]anilino]phenyl]-4-(trifluoromethoxy)benzamide;N-[4-[[4-(7-hydroxyheptanoyl)-2-methylphenyl]methyl]phenyl]-3-methoxybenzamide;7-hydroxy-1-[4-[[3-[2-(3-methoxyphenyl)-2-oxoethyl]phenyl]methyl]-3-methylphenyl]heptan-1-one;N-[4-[4-(5-hydroxypentylcarbamoyl)anilino]phenyl]-3-methoxybenzamide;N-[4-[4-[5-(2-hydroxypropan-2-yl)-3H-pyrazol-3-yl]anilino]phenyl]-3-methoxybenzamide;N-[4-[3-(5-imidazol-1-ylpentanoyl)anilino]phenyl]-4-methoxybenzamide
CID 159547840
4-(diethylamino)-1-[2-[(4-methoxyphenyl)methyl]phenyl]butan-1-one;5-(diethylamino)-1-[2-[(4-methoxyphenyl)methyl]phenyl]pentan-1-one;N-[2-(dimethylamino)ethyl]-4-(3-methoxyanilino)benzamide;N-[2-(dimethylamino)ethyl]-4-(4-methoxyanilino)-3-methylbenzamide;N-[2-(dimethylamino)ethyl]-4-[4-(trifluoromethoxy)anilino]benzamide;N-(3-imidazol-1-ylpropyl)-2-(3-methoxyanilino)benzamide;N-(3-imidazol-1-ylpropyl)-2-(4-methoxyanilino)benzamide;N-(3-imidazol-1-ylpropyl)-2-[4-(trifluoromethoxy)anilino]benzamide;N-(3-imidazol-1-ylpropyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;4-[(3-methoxyphenyl)methyl]-3-methyl-N-(3-methylbutyl)benzamide
CID 160844009
2-chloro-4-fluoro-3-propan-2-ylphenol;3-chloro-2-propan-2-ylphenol;3-chloro-2-propan-2-ylpyridine;5-cyclopropyl-4-propan-2-yl-1H-isoindole;5,6-dimethyl-4-propan-2-yl-1H-indene;5,6-dimethyl-4-propan-2-yl-1H-isoindole;1-fluoro-3-methoxy-2-propan-2-ylbenzene;5-fluoro-3-propan-2-yl-1H-indene;3-fluoro-2-propan-2-ylphenol;6-hydroxy-4-propan-2-yl-2,3-dihydroisoindol-1-one;5-methoxy-1-methyl-7-propan-2-ylindazole;2-methyl-7-propan-2-yl-3H-benzimidazol-5-ol;1-methyl-4-propan-2-yl-2,3-dihydroindol-6-ol;2-methyl-4-propan-2-ylindazol-6-ol;2-methyl-7-propan-2-ylindazol-5-ol;2-methyl-3-propan-2-yl-1H-indene;5-methyl-4-propan-2-yl-1H-indene;1-methyl-4-propan-2-ylindol-6-amine;1-methyl-4-propan-2-ylindol-6-ol;1-methyl-7-propan-2-ylindol-5-ol;3-propan-2-yl-1H-indene;2-propan-2-ylphenol
CID 157308458
5-cyclopropyl-4-propan-2-yl-1H-indene;bis(5,6-dimethyl-4-propan-2-yl-1H-indene);5-fluoro-3-propan-2-yl-1H-indene;6-hydroxy-4-propan-2-yl-2,3-dihydroisoindol-1-one;5-methoxy-1-methyl-7-propan-2-ylindole;2-methyl-7-propan-2-yl-3H-benzimidazol-5-ol;1-methyl-4-propan-2-yl-2,3-dihydroindol-6-ol;2-methyl-4-propan-2-ylindazol-6-ol;2-methyl-7-propan-2-ylindazol-5-ol;2-methyl-3-propan-2-yl-1H-indene;5-methyl-4-propan-2-yl-1H-indene;1-methyl-4-propan-2-ylindol-6-amine;1-methyl-4-propan-2-ylindol-6-ol;1-methyl-7-propan-2-ylindol-5-ol;3-propan-2-yl-1H-indene
CID 165079541

Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide?
The IUPAC name of 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide (CID 157144846) is 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide.
What is the SMILES notation for 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide?
The canonical SMILES for 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide is CC(C)CCNC(=O)c1ccc(Cc2ccc(OC(F)(F)F)cc2)cc1.CC(C)CCNC(=O)c1ccc(Cc2cccc(OC(F)(F)F)c2)cc1.CC(C)CCNC(=O)c1ccc(Cc2ccccc2OC(F)(F)F)cc1.CCN(CC)CCNC(=O)c1ccc(Nc2ccc(OC)cc2)cc1.CCN(CC)Cc1cn(-c2ccc(Nc3ccc(OC(F)(F)F)cc3)cc2)nn1.CCN(CC)Cc1cn(-c2ccc(Nc3ccc(OC)cc3)cc2)nn1.CCN(CC)Cc1cn(-c2ccc(Nc3cccc(OC)c3)cc2)nn1.COc1ccc(Cc2ccc(C(=O)NCCC(C)C)cc2)cc1.COc1ccc(Nc2ccc(-c3ncc(Cl)[nH]3)cc2C)cc1.COc1ccc(Nc2ccc(-n3cc(CCCO)nn3)cc2)cc1.COc1ccc(Nc2ccc(C(=O)NCCCN(C)C)cc2)cc1.COc1cccc(Cc2ccc(C(=O)NCCC(C)C)cc2)c1.COc1cccc(Nc2ccc(-n3cc(CCCO)nn3)cc2)c1.Cc1cc(C(=O)NCCC(C)C)ccc1Cc1ccccc1OC(F)(F)F.
What is the InChIKey of 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide?
The InChIKey is AKOYPPHFFOHPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24F3NO2.C20H22F3N5O.3C20H22F3NO2.2C20H25N5O.C20H27N3O2.2C20H25NO2.C19H25N3O2.2C18H20N4O2.C17H16ClN3O/c1-14(2)10-11-25-20(26)18-9-8-16(15(3)12-18)13-17-6-4-5-7-19(17)27-21(22,23)24;1-3-27(4-2)13-17-14-28(26-25-17)18-9-5-15(6-10-18)24-16-7-11-19(12-8-16)29-20(21,22)23;1-14(2)11-12-24-19(25)17-7-3-15(4-8-17)13-16-5-9-18(10-6-16)26-20(21,22)23;1-14(2)10-11-24-19(25)17-8-6-15(7-9-17)12-16-4-3-5-18(13-16)26-20(21,22)23;1-14(2)11-12-24-19(25)16-9-7-15(8-10-16)13-17-5-3-4-6-18(17)26-20(21,22)23;1-4-24(5-2)14-18-15-25(23-22-18)19-10-6-16(7-11-19)21-17-8-12-20(26-3)13-9-17;1-4-24(5-2)14-18-15-25(23-22-18)19-11-9-16(10-12-19)21-17-7-6-8-20(13-17)26-3;1-4-23(5-2)15-14-21-20(24)16-6-8-17(9-7-16)22-18-10-12-19(25-3)13-11-18;1-15(2)12-13-21-20(22)18-8-4-16(5-9-18)14-17-6-10-19(23-3)11-7-17;1-15(2)11-12-21-20(22)18-9-7-16(8-10-18)13-17-5-4-6-19(14-17)23-3;1-22(2)14-4-13-20-19(23)15-5-7-16(8-6-15)21-17-9-11-18(24-3)12-10-17;1-24-18-6-2-4-15(12-18)19-14-7-9-17(10-8-14)22-13-16(20-21-22)5-3-11-23;1-24-18-10-6-15(7-11-18)19-14-4-8-17(9-5-14)22-13-16(20-21-22)3-2-12-23;1-11-9-12(17-19-10-16(18)21-17)3-8-15(11)20-13-4-6-14(22-2)7-5-13/h4-9,12,14H,10-11,13H2,1-3H3,(H,25,26);5-12,14,24H,3-4,13H2,1-2H3;3-10,14H,11-13H2,1-2H3,(H,24,25);3-9,13-14H,10-12H2,1-2H3,(H,24,25);3-10,14H,11-13H2,1-2H3,(H,24,25);2*6-13,15,21H,4-5,14H2,1-3H3;6-13,22H,4-5,14-15H2,1-3H3,(H,21,24);4-11,15H,12-14H2,1-3H3,(H,21,22);4-10,14-15H,11-13H2,1-3H3,(H,21,22);5-12,21H,4,13-14H2,1-3H3,(H,20,23);2,4,6-10,12-13,19,23H,3,5,11H2,1H3;4-11,13,19,23H,2-3,12H2,1H3;3-10,20H,1-2H3,(H,19,21).
What are the key properties of 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide?
4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide has a molecular weight of 4838.23 g/mol, XLogP of 58.02, 101 rotatable bonds, 19 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-1H-imidazol-2-yl)-N-(4-methoxyphenyl)-2-methylaniline;N-[2-(diethylamino)ethyl]-4-(4-methoxyanilino)benzamide;4-[4-(diethylaminomethyl)triazol-1-yl]-N-(4-methoxyphenyl)aniline;N-[4-[4-(diethylaminomethyl)triazol-1-yl]phenyl]-3-methoxyaniline;4-[4-(diethylaminomethyl)triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]aniline;N-[3-(dimethylamino)propyl]-4-(4-methoxyanilino)benzamide;3-[1-[4-(3-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;3-[1-[4-(4-methoxyanilino)phenyl]triazol-4-yl]propan-1-ol;4-[(3-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;4-[(4-methoxyphenyl)methyl]-N-(3-methylbutyl)benzamide;N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]benzamide;N-(3-methylbutyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]benzamide;3-methyl-N-(3-methylbutyl)-4-[[2-(trifluoromethoxy)phenyl]methyl]benzamide is sourced from PubChem (CID 157144846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).