5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide

C124H113N17O6 — CID 157237549

IUPAC5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1ccccc1.Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1ccccn1.Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1cccnc1.O=C(NCC1CCCCC1)c1cccc(-c2ccnc(Nc3ccccc3)c2)c1.O=C(NCc1ccco1)c1cccc(-c2ccnc(Nc3ccccc3)c2)c1
InChIInChI=1S/C26H23N3O.2C25H22N4O.C25H27N3O.C23H19N3O2/c1-19-12-13-21(16-24(19)26(30)28-18-20-8-4-2-5-9-20)22-14-15-27-25(17-22)29-23-10-6-3-7-11-23;1-18-9-10-20(14-23(18)25(30)28-17-19-6-5-12-26-16-19)21-11-13-27-24(15-21)29-22-7-3-2-4-8-22;1-18-10-11-19(15-23(18)25(30)28-17-22-9-5-6-13-26-22)20-12-14-27-24(16-20)29-21-7-3-2-4-8-21;29-25(27-18-19-8-3-1-4-9-19)22-11-7-10-20(16-22)21-14-15-26-24(17-21)28-23-12-5-2-6-13-23;27-23(25-16-21-10-5-13-28-21)19-7-4-6-17(14-19)18-11-12-24-22(15-18)26-20-8-2-1-3-9-20/h2-17H,18H2,1H3,(H,27,29)(H,28,30);2*2-16H,17H2,1H3,(H,27,29)(H,28,30);2,5-7,10-17,19H,1,3-4,8-9,18H2,(H,26,28)(H,27,29);1-15H,16H2,(H,24,26)(H,25,27)
InChIKeyAUUWGMYAWGUUGS-UHFFFAOYSA-N
MW1937.38 g/mol
LogP26.80
Rot. Bonds30

About 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide

5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 157237549) has the molecular formula C124H113N17O6 and a molecular weight of 1937.38 g/mol. Its IUPAC name is 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide
PubChem CID157237549
Molecular FormulaC124H113N17O6
Molecular Weight1937.38 g/mol
Exact Mass1935.91
IUPAC Name5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1ccccc1.Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1ccccn1.Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1cccnc1.O=C(NCC1CCCCC1)c1cccc(-c2ccnc(Nc3ccccc3)c2)c1.O=C(NCc1ccco1)c1cccc(-c2ccnc(Nc3ccccc3)c2)c1
InChIInChI=1S/C26H23N3O.2C25H22N4O.C25H27N3O.C23H19N3O2/c1-19-12-13-21(16-24(19)26(30)28-18-20-8-4-2-5-9-20)22-14-15-27-25(17-22)29-23-10-6-3-7-11-23;1-18-9-10-20(14-23(18)25(30)28-17-19-6-5-12-26-16-19)21-11-13-27-24(15-21)29-22-7-3-2-4-8-22;1-18-10-11-19(15-23(18)25(30)28-17-22-9-5-6-13-26-22)20-12-14-27-24(16-20)29-21-7-3-2-4-8-21;29-25(27-18-19-8-3-1-4-9-19)22-11-7-10-20(16-22)21-14-15-26-24(17-21)28-23-12-5-2-6-13-23;27-23(25-16-21-10-5-13-28-21)19-7-4-6-17(14-19)18-11-12-24-22(15-18)26-20-8-2-1-3-9-20/h2-17H,18H2,1H3,(H,27,29)(H,28,30);2*2-16H,17H2,1H3,(H,27,29)(H,28,30);2,5-7,10-17,19H,1,3-4,8-9,18H2,(H,26,28)(H,27,29);1-15H,16H2,(H,24,26)(H,25,27)
InChIKeyAUUWGMYAWGUUGS-UHFFFAOYSA-N
XLogP26.80
TPSA309.02 Ų
H-Bond Donors10
H-Bond Acceptors18
Rotatable Bonds30
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001937.38
LogP ≤ 526.80
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1018

Analyze 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide with MolForge

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Launch Full Analysis

Related Compounds

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CID 46882361
N-(furan-2-ylmethyl)-1-[(2R,4S,5R)-5-(6-pentan-3-yl-2-pyridin-4-ylpyrimidin-4-yl)-1-azabicyclo[2.2.2]octan-2-yl]methanamine
CID 45360437
[4-[3-(Furan-2-ylmethylamino)pyrazin-2-yl]phenyl]-morpholin-4-ylmethanone
CID 172437539
N-[(1Z)-1-(Furan-2-YL)-3-oxo-3-[4-(pyridin-2-YL)piperazin-1-YL]prop-1-EN-2-YL]-3,4-dimethylbenzamide
CID 45105435
N-[[(2R,4S,5R)-5-(6-pentan-3-yl-2-pyridin-4-ylpyrimidin-4-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]furan-2-carboxamide
CID 40776981
N-[6-[4-(furan-2-ylmethyl)piperazin-1-yl]pyridin-3-yl]-2-[4-(trifluoromethyl)phenyl]benzamide
CID 10164309
(E)-3-(6-aminopyridin-3-yl)-N-[[4-[4-[4-(4,4-difluoropiperidine-1-carbonyl)phenyl]-2-(4-fluorophenyl)phenyl]furan-2-yl]methyl]prop-2-enamide
CID 126611927
1-[(6-Aminopyridin-3-yl)methyl]-3-[[5-[4-[4-(4,4-difluoropiperidine-1-carbonyl)phenyl]-2-(4-fluorophenyl)phenyl]furan-2-yl]methyl]urea
CID 130176928
N-[6-methyl-5-[6-[methyl-[[4-[5-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]pyridin-3-yl]-2-[(3S)-oxolan-3-yl]oxypyridin-3-yl]morpholin-2-yl]methyl]amino]-5-morpholin-4-ylpyridin-3-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide
CID 130425556
2-(furan-2-yl)-1-(5-isoquinolin-4-ylpyridine-2-carbonyl)-N-(6-methyl-2-pyridinyl)-5-(trifluoromethyl)piperidine-3-carboxamide
CID 141529614
[6-[[3-(aminomethyl)cyclohexyl]methylamino]-3-(trifluoromethyl)-2-pyridinyl]-(2-amino-3-pyridinyl)methanone;[6-[(4-amino-3-phenylbutan-2-yl)amino]-3-(trifluoromethyl)-2-pyridinyl]-(2-amino-3-pyridinyl)methanone;(2-amino-3-pyridinyl)-[5-(furan-2-yl)-2-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-4-pyridinyl]methanone;(2-amino-3-pyridinyl)-[6-[[(1S)-1-hydroxy-1-phenylpropan-2-yl]amino]-3-(trifluoromethyl)-2-pyridinyl]methanone;molecular hydrogen
CID 158035440
3-[2-(1-aminoisoquinolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;3-[2-(8-amino-1,7-naphthyridin-5-yl)ethynyl]-N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-4-methylbenzamide;3-[2-(8-amino-1,7-naphthyridin-5-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide
CID 158495133

Frequently Asked Questions

What is the IUPAC name of 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide (CID 157237549) is 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide is Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1ccccc1.Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1ccccn1.Cc1ccc(-c2ccnc(Nc3ccccc3)c2)cc1C(=O)NCc1cccnc1.O=C(NCC1CCCCC1)c1cccc(-c2ccnc(Nc3ccccc3)c2)c1.O=C(NCc1ccco1)c1cccc(-c2ccnc(Nc3ccccc3)c2)c1.
What is the InChIKey of 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is AUUWGMYAWGUUGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3O.2C25H22N4O.C25H27N3O.C23H19N3O2/c1-19-12-13-21(16-24(19)26(30)28-18-20-8-4-2-5-9-20)22-14-15-27-25(17-22)29-23-10-6-3-7-11-23;1-18-9-10-20(14-23(18)25(30)28-17-19-6-5-12-26-16-19)21-11-13-27-24(15-21)29-22-7-3-2-4-8-22;1-18-10-11-19(15-23(18)25(30)28-17-22-9-5-6-13-26-22)20-12-14-27-24(16-20)29-21-7-3-2-4-8-21;29-25(27-18-19-8-3-1-4-9-19)22-11-7-10-20(16-22)21-14-15-26-24(17-21)28-23-12-5-2-6-13-23;27-23(25-16-21-10-5-13-28-21)19-7-4-6-17(14-19)18-11-12-24-22(15-18)26-20-8-2-1-3-9-20/h2-17H,18H2,1H3,(H,27,29)(H,28,30);2*2-16H,17H2,1H3,(H,27,29)(H,28,30);2,5-7,10-17,19H,1,3-4,8-9,18H2,(H,26,28)(H,27,29);1-15H,16H2,(H,24,26)(H,25,27).
What are the key properties of 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide?
5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 1937.38 g/mol, XLogP of 26.80, 30 rotatable bonds, 10 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-anilino-4-pyridinyl)-N-benzyl-2-methylbenzamide;3-(2-anilino-4-pyridinyl)-N-(cyclohexylmethyl)benzamide;3-(2-anilino-4-pyridinyl)-N-(furan-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-2-ylmethyl)benzamide;5-(2-anilino-4-pyridinyl)-2-methyl-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 157237549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).