5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline

C106H115Cl3F16N16O18S4 — CID 157091272

About 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline

5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline (PubChem CID 157091272) has the molecular formula C106H115Cl3F16N16O18S4 and a molecular weight of 2439.77 g/mol. Its IUPAC name is 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline.

Molecular Properties

• Compound Name: 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline
• PubChem CID: 157091272
• Molecular Formula: C106H115Cl3F16N16O18S4
• Molecular Weight: 2439.77 g/mol
• Exact Mass: 2436.63
• IUPAC Name: 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline
• SMILES: CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1N.CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1Nc1cc(CC(=O)C2CC2)nc2c1N=C(C(F)F)C2.CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1Nc1cc(CC(=O)C2CC2)nc2c1nc(C(F)F)n2C1CCCCO1.CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1Nc1cc(Cl)nc2c1nc(C(F)F)n2C1CCCCO1.FC(F)c1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1
• InChI: InChI=1S/C29H32F4N4O5S.C25H25F4N3O4S.C24H25ClF4N4O4S.C12H11Cl2F2N3O.C12H15F2NO3S.C4H7NO/c1-43(39,40)23-12-17(22-9-10-29(32,33)15-42-22)7-8-19(23)35-20-13-18(14-21(38)16-5-6-16)34-27-25(20)36-28(26(30)31)37(27)24-4-2-3-11-41-24;1-37(34,35)22-8-14(21-6-7-25(28,29)12-36-21)4-5-16(22)31-17-9-15(10-20(33)13-2-3-13)30-18-11-19(24(26)27)32-23(17)18;1-38(34,35)17-10-13(16-7-8-24(28,29)12-37-16)5-6-14(17)30-15-11-18(25)31-22-20(15)32-23(21(26)27)33(22)19-4-2-3-9-36-19;13-6-5-7(14)17-11-9(6)18-12(10(15)16)19(11)8-3-1-2-4-20-8;1-19(16,17)11-6-8(2-3-9(11)15)10-4-5-12(13,14)7-18-10;5-4(6)3-1-2-3/h7-8,12-13,16,22,24,26H,2-6,9-11,14-15H2,1H3,(H,34,35);4-5,8-9,13,21,24H,2-3,6-7,10-12H2,1H3,(H,30,31);5-6,10-11,16,19,21H,2-4,7-9,12H2,1H3,(H,30,31);5,8,10H,1-4H2;2-3,6,10H,4-5,7,15H2,1H3;3H,1-2H2,(H2,5,6)
• InChIKey: AERPWELQVFJHPI-UHFFFAOYSA-N
• XLogP: 24.13
• TPSA: 457.89 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 33
• Rotatable Bonds: 28
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2439.77
LogP ≤ 5	24.13
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	33

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-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline?

The IUPAC name of 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline (CID 157091272) is 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline.

What is the SMILES notation for 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline?

The canonical SMILES for 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline is CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1N.CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1Nc1cc(CC(=O)C2CC2)nc2c1N=C(C(F)F)C2.CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1Nc1cc(CC(=O)C2CC2)nc2c1nc(C(F)F)n2C1CCCCO1.CS(=O)(=O)c1cc(C2CCC(F)(F)CO2)ccc1Nc1cc(Cl)nc2c1nc(C(F)F)n2C1CCCCO1.FC(F)c1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.NC(=O)C1CC1.

What is the InChIKey of 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline?

The InChIKey is AERPWELQVFJHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32F4N4O5S.C25H25F4N3O4S.C24H25ClF4N4O4S.C12H11Cl2F2N3O.C12H15F2NO3S.C4H7NO/c1-43(39,40)23-12-17(22-9-10-29(32,33)15-42-22)7-8-19(23)35-20-13-18(14-21(38)16-5-6-16)34-27-25(20)36-28(26(30)31)37(27)24-4-2-3-11-41-24;1-37(34,35)22-8-14(21-6-7-25(28,29)12-36-21)4-5-16(22)31-17-9-15(10-20(33)13-2-3-13)30-18-11-19(24(26)27)32-23(17)18;1-38(34,35)17-10-13(16-7-8-24(28,29)12-37-16)5-6-14(17)30-15-11-18(25)31-22-20(15)32-23(21(26)27)33(22)19-4-2-3-9-36-19;13-6-5-7(14)17-11-9(6)18-12(10(15)16)19(11)8-3-1-2-4-20-8;1-19(16,17)11-6-8(2-3-9(11)15)10-4-5-12(13,14)7-18-10;5-4(6)3-1-2-3/h7-8,12-13,16,22,24,26H,2-6,9-11,14-15H2,1H3,(H,34,35);4-5,8-9,13,21,24H,2-3,6-7,10-12H2,1H3,(H,30,31);5-6,10-11,16,19,21H,2-4,7-9,12H2,1H3,(H,30,31);5,8,10H,1-4H2;2-3,6,10H,4-5,7,15H2,1H3;3H,1-2H2,(H2,5,6).

What are the key properties of 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline?

5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline has a molecular weight of 2439.77 g/mol, XLogP of 24.13, 28 rotatable bonds, 5 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-2-(difluoromethyl)-N-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylphenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;cyclopropanecarboxamide;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-5-yl]ethanone;1-cyclopropyl-2-[2-(difluoromethyl)-7-[4-(5,5-difluorooxan-2-yl)-2-methylsulfonylanilino]-3H-pyrrolo[3,2-b]pyridin-5-yl]ethanone;5,7-dichloro-2-(difluoromethyl)-3-(oxan-2-yl)imidazo[4,5-b]pyridine;4-(5,5-difluorooxan-2-yl)-2-methylsulfonylaniline is sourced from PubChem (CID 157091272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).