N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine

C76H89ClN18O8S3 — CID 158556435

About N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine

N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine (PubChem CID 158556435) has the molecular formula C76H89ClN18O8S3 and a molecular weight of 1514.32 g/mol. Its IUPAC name is N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine.

Molecular Properties

• Compound Name: N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine
• PubChem CID: 158556435
• Molecular Formula: C76H89ClN18O8S3
• Molecular Weight: 1514.32 g/mol
• Exact Mass: 1512.60
• IUPAC Name: N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine
• SMILES: CC1=Nc2c(Nc3ccccc3N(C)S(C)(=O)=O)cc(Cc3cccc(C)n3)nc2C1.Cc1cccc(Cc2cc(Nc3ccccc3N(C)S(C)(=O)=O)c3nc(C)n(C4CCCCO4)c3n2)n1.Cc1cccc(N)n1.Cc1nc2c(Nc3ccccc3N(C)S(C)(=O)=O)cc(Cl)nc2n1C1CCCCO1
• InChI: InChI=1S/C27H32N6O3S.C23H25N5O2S.C20H24ClN5O3S.C6H8N2/c1-18-10-9-11-20(28-18)16-21-17-23(31-22-12-5-6-13-24(22)32(3)37(4,34)35)26-27(30-21)33(19(2)29-26)25-14-7-8-15-36-25;1-15-8-7-9-17(24-15)13-18-14-21(23-20(26-18)12-16(2)25-23)27-19-10-5-6-11-22(19)28(3)31(4,29)30;1-13-22-19-15(23-14-8-4-5-9-16(14)25(2)30(3,27)28)12-17(21)24-20(19)26(13)18-10-6-7-11-29-18;1-5-3-2-4-6(7)8-5/h5-6,9-13,17,25H,7-8,14-16H2,1-4H3,(H,30,31);5-11,14H,12-13H2,1-4H3,(H,26,27);4-5,8-9,12,18H,6-7,10-11H2,1-3H3,(H,23,24);2-4H,1H3,(H2,7,8)
• InChIKey: HQIWRJXDWFNVPI-UHFFFAOYSA-N
• XLogP: 14.24
• TPSA: 318.05 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 23
• Rotatable Bonds: 18
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1514.32
LogP ≤ 5	14.24
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine?

The IUPAC name of N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine (CID 158556435) is N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine.

What is the SMILES notation for N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine?

The canonical SMILES for N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine is CC1=Nc2c(Nc3ccccc3N(C)S(C)(=O)=O)cc(Cc3cccc(C)n3)nc2C1.Cc1cccc(Cc2cc(Nc3ccccc3N(C)S(C)(=O)=O)c3nc(C)n(C4CCCCO4)c3n2)n1.Cc1cccc(N)n1.Cc1nc2c(Nc3ccccc3N(C)S(C)(=O)=O)cc(Cl)nc2n1C1CCCCO1.

What is the InChIKey of N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine?

The InChIKey is HQIWRJXDWFNVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N6O3S.C23H25N5O2S.C20H24ClN5O3S.C6H8N2/c1-18-10-9-11-20(28-18)16-21-17-23(31-22-12-5-6-13-24(22)32(3)37(4,34)35)26-27(30-21)33(19(2)29-26)25-14-7-8-15-36-25;1-15-8-7-9-17(24-15)13-18-14-21(23-20(26-18)12-16(2)25-23)27-19-10-5-6-11-22(19)28(3)31(4,29)30;1-13-22-19-15(23-14-8-4-5-9-16(14)25(2)30(3,27)28)12-17(21)24-20(19)26(13)18-10-6-7-11-29-18;1-5-3-2-4-6(7)8-5/h5-6,9-13,17,25H,7-8,14-16H2,1-4H3,(H,30,31);5-11,14H,12-13H2,1-4H3,(H,26,27);4-5,8-9,12,18H,6-7,10-11H2,1-3H3,(H,23,24);2-4H,1H3,(H2,7,8).

What are the key properties of N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine?

N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine has a molecular weight of 1514.32 g/mol, XLogP of 14.24, 18 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[[5-chloro-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]-N-methylmethanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;N-methyl-N-[2-[[2-methyl-5-[(6-methyl-2-pyridinyl)methyl]-3H-pyrrolo[3,2-b]pyridin-7-yl]amino]phenyl]methanesulfonamide;6-methylpyridin-2-amine is sourced from PubChem (CID 158556435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).