N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine

C94H119Cl3N20O14S4 — CID 160558959

About N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine

N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine (PubChem CID 160558959) has the molecular formula C94H119Cl3N20O14S4 and a molecular weight of 1987.74 g/mol. Its IUPAC name is N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine.

Molecular Properties

• Compound Name: N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine
• PubChem CID: 160558959
• Molecular Formula: C94H119Cl3N20O14S4
• Molecular Weight: 1987.74 g/mol
• Exact Mass: 1984.72
• IUPAC Name: N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine
• SMILES: CC1=Nc2c(Nc3ccc(C)cc3N(C)S(C)(=O)=O)cc(CC(=O)C3CC3)nc2C1.Cc1ccc(N)c(N(C)S(C)(=O)=O)c1.Cc1ccc(Nc2cc(CC(=O)C3CC3)nc3c2nc(C)n3C2CCCCO2)c(N(C)S(C)(=O)=O)c1.Cc1ccc(Nc2cc(Cl)nc3c2nc(C)n3C2CCCCO2)c(N(C)S(C)(=O)=O)c1.Cc1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1
• InChI: InChI=1S/C26H33N5O4S.C22H26N4O3S.C21H26ClN5O3S.C12H13Cl2N3O.C9H14N2O2S.C4H7NO/c1-16-8-11-20(22(13-16)30(3)36(4,33)34)29-21-14-19(15-23(32)18-9-10-18)28-26-25(21)27-17(2)31(26)24-7-5-6-12-35-24;1-13-5-8-17(20(9-13)26(3)30(4,28)29)25-19-11-16(12-21(27)15-6-7-15)24-18-10-14(2)23-22(18)19;1-13-8-9-15(17(11-13)26(3)31(4,28)29)24-16-12-18(22)25-21-20(16)23-14(2)27(21)19-7-5-6-10-30-19;1-7-15-11-8(13)6-9(14)16-12(11)17(7)10-4-2-3-5-18-10;1-7-4-5-8(10)9(6-7)11(2)14(3,12)13;5-4(6)3-1-2-3/h8,11,13-14,18,24H,5-7,9-10,12,15H2,1-4H3,(H,28,29);5,8-9,11,15H,6-7,10,12H2,1-4H3,(H,24,25);8-9,11-12,19H,5-7,10H2,1-4H3,(H,24,25);6,10H,2-5H2,1H3;4-6H,10H2,1-3H3;3H,1-2H2,(H2,5,6)
• InChIKey: QZBCUQLUCYXXKO-UHFFFAOYSA-N
• XLogP: 17.25
• TPSA: 433.93 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 29
• Rotatable Bonds: 24
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1987.74
LogP ≤ 5	17.25
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?

The IUPAC name of N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine (CID 160558959) is N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine.

What is the SMILES notation for N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?

The canonical SMILES for N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine is CC1=Nc2c(Nc3ccc(C)cc3N(C)S(C)(=O)=O)cc(CC(=O)C3CC3)nc2C1.Cc1ccc(N)c(N(C)S(C)(=O)=O)c1.Cc1ccc(Nc2cc(CC(=O)C3CC3)nc3c2nc(C)n3C2CCCCO2)c(N(C)S(C)(=O)=O)c1.Cc1ccc(Nc2cc(Cl)nc3c2nc(C)n3C2CCCCO2)c(N(C)S(C)(=O)=O)c1.Cc1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1.

What is the InChIKey of N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?

The InChIKey is QZBCUQLUCYXXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O4S.C22H26N4O3S.C21H26ClN5O3S.C12H13Cl2N3O.C9H14N2O2S.C4H7NO/c1-16-8-11-20(22(13-16)30(3)36(4,33)34)29-21-14-19(15-23(32)18-9-10-18)28-26-25(21)27-17(2)31(26)24-7-5-6-12-35-24;1-13-5-8-17(20(9-13)26(3)30(4,28)29)25-19-11-16(12-21(27)15-6-7-15)24-18-10-14(2)23-22(18)19;1-13-8-9-15(17(11-13)26(3)31(4,28)29)24-16-12-18(22)25-21-20(16)23-14(2)27(21)19-7-5-6-10-30-19;1-7-15-11-8(13)6-9(14)16-12(11)17(7)10-4-2-3-5-18-10;1-7-4-5-8(10)9(6-7)11(2)14(3,12)13;5-4(6)3-1-2-3/h8,11,13-14,18,24H,5-7,9-10,12,15H2,1-4H3,(H,28,29);5,8-9,11,15H,6-7,10,12H2,1-4H3,(H,24,25);8-9,11-12,19H,5-7,10H2,1-4H3,(H,24,25);6,10H,2-5H2,1H3;4-6H,10H2,1-3H3;3H,1-2H2,(H2,5,6).

What are the key properties of N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine?

N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine has a molecular weight of 1987.74 g/mol, XLogP of 17.25, 24 rotatable bonds, 5 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-amino-5-methylphenyl)-N-methylmethanesulfonamide;N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;cyclopropanecarboxamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;N-[2-[[5-(2-cyclopropyl-2-oxoethyl)-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]-5-methylphenyl]-N-methylmethanesulfonamide;5,7-dichloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 160558959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).