5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid

C129H124Cl3N43O12 — CID 158806109

About 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid

5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid (PubChem CID 158806109) has the molecular formula C129H124Cl3N43O12 and a molecular weight of 2575.06 g/mol. Its IUPAC name is 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid
• PubChem CID: 158806109
• Molecular Formula: C129H124Cl3N43O12
• Molecular Weight: 2575.06 g/mol
• Exact Mass: 2571.95
• IUPAC Name: 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid
• SMILES: Cc1cc(Cc2ccc(NC(=O)c3ccc(Nc4ccnc5ccccc45)cn3)cc2)nc(N)n1.Cc1cc(Cl)nc(N)n1.Cc1cc(Nc2ccc(N)cc2)nc(N)n1.Cc1cc(Nc2ccc(N)cc2)nc(N)n1.Cc1cc(Nc2ccc(NC(=O)c3ccc(N)cn3)cc2)nc(N)n1.Cc1cc(Nc2ccc(NC(=O)c3ccc([N+](=O)[O-])cn3)cc2)nc(N)n1.Cc1ccc(N)cc1.Cc1ccc(Nc2cc(C)nc(N)n2)cc1.Clc1ccnc2ccccc12.O=C(Cl)c1ccc([N+](=O)[O-])cc1.O=C(O)c1ccc([N+](=O)[O-])cn1
• InChI: InChI=1S/C27H23N7O.C17H15N7O3.C17H17N7O.C12H14N4.2C11H13N5.C9H6ClN.C7H4ClNO3.C7H9N.C6H4N2O4.C5H6ClN3/c1-17-14-21(34-27(28)31-17)15-18-6-8-19(9-7-18)33-26(35)25-11-10-20(16-30-25)32-24-12-13-29-23-5-3-2-4-22(23)24;1-10-8-15(23-17(18)20-10)21-11-2-4-12(5-3-11)22-16(25)14-7-6-13(9-19-14)24(26)27;1-10-8-15(24-17(19)21-10)22-12-3-5-13(6-4-12)23-16(25)14-7-2-11(18)9-20-14;1-8-3-5-10(6-4-8)15-11-7-9(2)14-12(13)16-11;2*1-7-6-10(16-11(13)14-7)15-9-4-2-8(12)3-5-9;10-8-5-6-11-9-4-2-1-3-7(8)9;8-7(10)5-1-3-6(4-2-5)9(11)12;1-6-2-4-7(8)5-3-6;9-6(10)5-2-1-4(3-7-5)8(11)12;1-3-2-4(6)9-5(7)8-3/h2-14,16H,15H2,1H3,(H,29,32)(H,33,35)(H2,28,31,34);2-9H,1H3,(H,22,25)(H3,18,20,21,23);2-9H,18H2,1H3,(H,23,25)(H3,19,21,22,24);3-7H,1-2H3,(H3,13,14,15,16);2*2-6H,12H2,1H3,(H3,13,14,15,16);1-6H;1-4H;2-5H,8H2,1H3;1-3H,(H,9,10);2H,1H3,(H2,7,8,9)
• InChIKey: IUCDGPMACUXKEE-UHFFFAOYSA-N
• XLogP: 23.86
• TPSA: 887.29 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 48
• Rotatable Bonds: 25
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2575.06
LogP ≤ 5	23.86
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid?

The IUPAC name of 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid (CID 158806109) is 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid.

What is the SMILES notation for 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid?

The canonical SMILES for 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid is Cc1cc(Cc2ccc(NC(=O)c3ccc(Nc4ccnc5ccccc45)cn3)cc2)nc(N)n1.Cc1cc(Cl)nc(N)n1.Cc1cc(Nc2ccc(N)cc2)nc(N)n1.Cc1cc(Nc2ccc(N)cc2)nc(N)n1.Cc1cc(Nc2ccc(NC(=O)c3ccc(N)cn3)cc2)nc(N)n1.Cc1cc(Nc2ccc(NC(=O)c3ccc([N+](=O)[O-])cn3)cc2)nc(N)n1.Cc1ccc(N)cc1.Cc1ccc(Nc2cc(C)nc(N)n2)cc1.Clc1ccnc2ccccc12.O=C(Cl)c1ccc([N+](=O)[O-])cc1.O=C(O)c1ccc([N+](=O)[O-])cn1.

What is the InChIKey of 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid?

The InChIKey is IUCDGPMACUXKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N7O.C17H15N7O3.C17H17N7O.C12H14N4.2C11H13N5.C9H6ClN.C7H4ClNO3.C7H9N.C6H4N2O4.C5H6ClN3/c1-17-14-21(34-27(28)31-17)15-18-6-8-19(9-7-18)33-26(35)25-11-10-20(16-30-25)32-24-12-13-29-23-5-3-2-4-22(23)24;1-10-8-15(23-17(18)20-10)21-11-2-4-12(5-3-11)22-16(25)14-7-6-13(9-19-14)24(26)27;1-10-8-15(24-17(19)21-10)22-12-3-5-13(6-4-12)23-16(25)14-7-2-11(18)9-20-14;1-8-3-5-10(6-4-8)15-11-7-9(2)14-12(13)16-11;2*1-7-6-10(16-11(13)14-7)15-9-4-2-8(12)3-5-9;10-8-5-6-11-9-4-2-1-3-7(8)9;8-7(10)5-1-3-6(4-2-5)9(11)12;1-6-2-4-7(8)5-3-6;9-6(10)5-2-1-4(3-7-5)8(11)12;1-3-2-4(6)9-5(7)8-3/h2-14,16H,15H2,1H3,(H,29,32)(H,33,35)(H2,28,31,34);2-9H,1H3,(H,22,25)(H3,18,20,21,23);2-9H,18H2,1H3,(H,23,25)(H3,19,21,22,24);3-7H,1-2H3,(H3,13,14,15,16);2*2-6H,12H2,1H3,(H3,13,14,15,16);1-6H;1-4H;2-5H,8H2,1H3;1-3H,(H,9,10);2H,1H3,(H2,7,8,9).

What are the key properties of 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid?

5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid has a molecular weight of 2575.06 g/mol, XLogP of 23.86, 25 rotatable bonds, 21 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 5-amino-N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]pyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)amino]phenyl]-5-nitropyridine-2-carboxamide;N-[4-[(2-amino-6-methylpyrimidin-4-yl)methyl]phenyl]-5-(quinolin-4-ylamino)pyridine-2-carboxamide;bis(4-N-(4-aminophenyl)-6-methylpyrimidine-2,4-diamine);4-chloro-6-methylpyrimidin-2-amine;4-chloroquinoline;4-methylaniline;6-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;4-nitrobenzoyl chloride;5-nitropyridine-2-carboxylic acid is sourced from PubChem (CID 158806109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).