N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide

C114H102ClF5N22O9S2 — CID 158463942

IUPACN-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(N)=O)ccc3Cl)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc([N+](=O)[O-])ccc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3ccc(C)c(F)c3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cscc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sccc3C)c(N)n2)cc1
InChIInChI=1S/C20H17ClN4O2.C20H17F2N3O.C20H18N4O3.C18H16F3N5O.2C18H17N3OS/c1-11-2-4-12(5-3-11)20(27)25-17-9-7-14(18(22)24-17)15-10-13(19(23)26)6-8-16(15)21;1-11-3-6-13(7-4-11)20(26)25-16-10-9-15(19(23)24-16)14-8-5-12(2)17(21)18(14)22;1-12-3-6-14(7-4-12)20(25)23-18-10-9-16(19(21)22-18)17-11-15(24(26)27)8-5-13(17)2;1-10-3-5-11(6-4-10)17(27)24-15-8-7-12(16(22)23-15)13-9-14(18(19,20)21)25-26(13)2;1-11-3-5-13(6-4-11)18(22)21-16-8-7-14(17(19)20-16)15-10-23-9-12(15)2;1-11-3-5-13(6-4-11)18(22)21-15-8-7-14(17(19)20-15)16-12(2)9-10-23-16/h2-10H,1H3,(H2,23,26)(H3,22,24,25,27);3-10H,1-2H3,(H3,23,24,25,26);3-11H,1-2H3,(H3,21,22,23,25);3-9H,1-2H3,(H3,22,23,24,27);2*3-10H,1-2H3,(H3,19,20,21,22)
InChIKeyHFNBPOUCQHXCFG-UHFFFAOYSA-N
MW2118.79 g/mol
LogP24.40
Rot. Bonds20

About N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide

N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide (PubChem CID 158463942) has the molecular formula C114H102ClF5N22O9S2 and a molecular weight of 2118.79 g/mol. Its IUPAC name is N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
PubChem CID158463942
Molecular FormulaC114H102ClF5N22O9S2
Molecular Weight2118.79 g/mol
Exact Mass2116.73
IUPAC NameN-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(N)=O)ccc3Cl)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc([N+](=O)[O-])ccc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3ccc(C)c(F)c3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cscc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sccc3C)c(N)n2)cc1
InChIInChI=1S/C20H17ClN4O2.C20H17F2N3O.C20H18N4O3.C18H16F3N5O.2C18H17N3OS/c1-11-2-4-12(5-3-11)20(27)25-17-9-7-14(18(22)24-17)15-10-13(19(23)26)6-8-16(15)21;1-11-3-6-13(7-4-11)20(26)25-16-10-9-15(19(23)24-16)14-8-5-12(2)17(21)18(14)22;1-12-3-6-14(7-4-12)20(25)23-18-10-9-16(19(21)22-18)17-11-15(24(26)27)8-5-13(17)2;1-10-3-5-11(6-4-10)17(27)24-15-8-7-12(16(22)23-15)13-9-14(18(19,20)21)25-26(13)2;1-11-3-5-13(6-4-11)18(22)21-16-8-7-14(17(19)20-16)15-10-23-9-12(15)2;1-11-3-5-13(6-4-11)18(22)21-15-8-7-14(17(19)20-15)16-12(2)9-10-23-16/h2-10H,1H3,(H2,23,26)(H3,22,24,25,27);3-10H,1-2H3,(H3,23,24,25,26);3-11H,1-2H3,(H3,21,22,23,25);3-9H,1-2H3,(H3,22,23,24,27);2*3-10H,1-2H3,(H3,19,20,21,22)
InChIKeyHFNBPOUCQHXCFG-UHFFFAOYSA-N
XLogP24.40
TPSA512.11 Ų
H-Bond Donors13
H-Bond Acceptors25
Rotatable Bonds20
Heavy Atoms153
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002118.79
LogP ≤ 524.40
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[6-amino-5-(5-chlorothiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
CID 157101142
N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
CID 161306530

Frequently Asked Questions

What is the IUPAC name of N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
The IUPAC name of N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide (CID 158463942) is N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide.
What is the SMILES notation for N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
The canonical SMILES for N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide is Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(N)=O)ccc3Cl)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc([N+](=O)[O-])ccc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3ccc(C)c(F)c3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cscc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sccc3C)c(N)n2)cc1.
What is the InChIKey of N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
The InChIKey is HFNBPOUCQHXCFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O2.C20H17F2N3O.C20H18N4O3.C18H16F3N5O.2C18H17N3OS/c1-11-2-4-12(5-3-11)20(27)25-17-9-7-14(18(22)24-17)15-10-13(19(23)26)6-8-16(15)21;1-11-3-6-13(7-4-11)20(26)25-16-10-9-15(19(23)24-16)14-8-5-12(2)17(21)18(14)22;1-12-3-6-14(7-4-12)20(25)23-18-10-9-16(19(21)22-18)17-11-15(24(26)27)8-5-13(17)2;1-10-3-5-11(6-4-10)17(27)24-15-8-7-12(16(22)23-15)13-9-14(18(19,20)21)25-26(13)2;1-11-3-5-13(6-4-11)18(22)21-16-8-7-14(17(19)20-16)15-10-23-9-12(15)2;1-11-3-5-13(6-4-11)18(22)21-15-8-7-14(17(19)20-15)16-12(2)9-10-23-16/h2-10H,1H3,(H2,23,26)(H3,22,24,25,27);3-10H,1-2H3,(H3,23,24,25,26);3-11H,1-2H3,(H3,21,22,23,25);3-9H,1-2H3,(H3,22,23,24,27);2*3-10H,1-2H3,(H3,19,20,21,22).
What are the key properties of N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide?
N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide has a molecular weight of 2118.79 g/mol, XLogP of 24.40, 20 rotatable bonds, 13 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-amino-5-(2,3-difluoro-4-methylphenyl)-2-pyridinyl]-4-methylbenzamide;3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzamide;N-[6-amino-5-(2-methyl-5-nitrophenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide is sourced from PubChem (CID 158463942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).