5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline

C112H127Cl3F2N30O11S4 — CID 159048154

About 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline

5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline (PubChem CID 159048154) has the molecular formula C112H127Cl3F2N30O11S4 and a molecular weight of 2342.07 g/mol. Its IUPAC name is 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline.

Molecular Properties

• Compound Name: 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline
• PubChem CID: 159048154
• Molecular Formula: C112H127Cl3F2N30O11S4
• Molecular Weight: 2342.07 g/mol
• Exact Mass: 2338.82
• IUPAC Name: 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline
• SMILES: CC1=Nc2c(Nc3ccc(-c4cc(C)n(C)n4)cc3S(C)(=O)=O)cc(Cc3cnc(C)c(C)n3)nc2C1.Cc1cc(-c2ccc(N)c(S(C)(=O)=O)c2)nn1C.Cc1cc(-c2ccc(Nc3cc(Cl)nc4c3nc(C)n4C3CCCCO3)c(S(C)(=O)=O)c2)nn1C.Cc1ncc(Cc2cc(Nc3ccc(-c4cc(C)n(C)n4)cc3S(C)(=O)=O)c3nc(C)n(C4CCCCO4)c3n2)nc1C.Cc1ncc(N)nc1C.FC(F)c1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1
• InChI: InChI=1S/C31H36N8O3S.C27H29N7O2S.C24H27ClN6O3S.C12H11Cl2F2N3O.C12H15N3O2S.C6H9N3/c1-18-13-26(37-38(18)5)22-10-11-25(28(14-22)43(6,40)41)36-27-16-23(15-24-17-32-19(2)20(3)33-24)35-31-30(27)34-21(4)39(31)29-9-7-8-12-42-29;1-15-9-24-27(29-15)25(13-20(31-24)12-21-14-28-17(3)18(4)30-21)32-22-8-7-19(11-26(22)37(6,35)36)23-10-16(2)34(5)33-23;1-14-11-18(29-30(14)3)16-8-9-17(20(12-16)35(4,32)33)27-19-13-21(25)28-24-23(19)26-15(2)31(24)22-7-5-6-10-34-22;13-6-5-7(14)17-11-9(6)18-12(10(15)16)19(11)8-3-1-2-4-20-8;1-8-6-11(14-15(8)2)9-4-5-10(13)12(7-9)18(3,16)17;1-4-5(2)9-6(7)3-8-4/h10-11,13-14,16-17,29H,7-9,12,15H2,1-6H3,(H,35,36);7-8,10-11,13-14H,9,12H2,1-6H3,(H,31,32);8-9,11-13,22H,5-7,10H2,1-4H3,(H,27,28);5,8,10H,1-4H2;4-7H,13H2,1-3H3;3H,1-2H3,(H2,7,9)
• InChIKey: JWXMTCMLAYRZRK-UHFFFAOYSA-N
• XLogP: 21.26
• TPSA: 518.38 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 41
• Rotatable Bonds: 22
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2342.07
LogP ≤ 5	21.26
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	41

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 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline?

The IUPAC name of 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline (CID 159048154) is 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline.

What is the SMILES notation for 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline?

The canonical SMILES for 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline is CC1=Nc2c(Nc3ccc(-c4cc(C)n(C)n4)cc3S(C)(=O)=O)cc(Cc3cnc(C)c(C)n3)nc2C1.Cc1cc(-c2ccc(N)c(S(C)(=O)=O)c2)nn1C.Cc1cc(-c2ccc(Nc3cc(Cl)nc4c3nc(C)n4C3CCCCO3)c(S(C)(=O)=O)c2)nn1C.Cc1ncc(Cc2cc(Nc3ccc(-c4cc(C)n(C)n4)cc3S(C)(=O)=O)c3nc(C)n(C4CCCCO4)c3n2)nc1C.Cc1ncc(N)nc1C.FC(F)c1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.

What is the InChIKey of 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline?

The InChIKey is JWXMTCMLAYRZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H36N8O3S.C27H29N7O2S.C24H27ClN6O3S.C12H11Cl2F2N3O.C12H15N3O2S.C6H9N3/c1-18-13-26(37-38(18)5)22-10-11-25(28(14-22)43(6,40)41)36-27-16-23(15-24-17-32-19(2)20(3)33-24)35-31-30(27)34-21(4)39(31)29-9-7-8-12-42-29;1-15-9-24-27(29-15)25(13-20(31-24)12-21-14-28-17(3)18(4)30-21)32-22-8-7-19(11-26(22)37(6,35)36)23-10-16(2)34(5)33-23;1-14-11-18(29-30(14)3)16-8-9-17(20(12-16)35(4,32)33)27-19-13-21(25)28-24-23(19)26-15(2)31(24)22-7-5-6-10-34-22;13-6-5-7(14)17-11-9(6)18-12(10(15)16)19(11)8-3-1-2-4-20-8;1-8-6-11(14-15(8)2)9-4-5-10(13)12(7-9)18(3,16)17;1-4-5(2)9-6(7)3-8-4/h10-11,13-14,16-17,29H,7-9,12,15H2,1-6H3,(H,35,36);7-8,10-11,13-14H,9,12H2,1-6H3,(H,31,32);8-9,11-13,22H,5-7,10H2,1-4H3,(H,27,28);5,8,10H,1-4H2;4-7H,13H2,1-3H3;3H,1-2H3,(H2,7,9).

What are the key properties of 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline?

5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline has a molecular weight of 2342.07 g/mol, XLogP of 21.26, 22 rotatable bonds, 5 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;5,6-dimethylpyrazin-2-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5-[(5,6-dimethylpyrazin-2-yl)methyl]-N-[4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylphenyl]-2-methyl-3H-pyrrolo[3,2-b]pyridin-7-amine;4-(1,5-dimethylpyrazol-3-yl)-2-methylsulfonylaniline is sourced from PubChem (CID 159048154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).