5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline

C84H90Cl3F6N21O6 — CID 159873258

About 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline

5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline (PubChem CID 159873258) has the molecular formula C84H90Cl3F6N21O6 and a molecular weight of 1710.13 g/mol. Its IUPAC name is 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline.

Molecular Properties

• Compound Name: 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline
• PubChem CID: 159873258
• Molecular Formula: C84H90Cl3F6N21O6
• Molecular Weight: 1710.13 g/mol
• Exact Mass: 1707.64
• IUPAC Name: 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline
• SMILES: COc1c(N)cccc1-c1ccn(C)n1.COc1c(Nc2cc(Cc3ccc(C)c(C)n3)nc3c2nc(C(F)F)n3C2CCCCO2)cccc1-c1ccn(C)n1.COc1c(Nc2cc(Cl)nc3c2nc(C(F)F)n3C2CCCCO2)cccc1-c1ccn(C)n1.Cc1ccc(N)nc1C.FC(F)c1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1
• InChI: InChI=1S/C31H33F2N7O2.C23H23ClF2N6O2.C12H11Cl2F2N3O.C11H13N3O.C7H10N2/c1-18-11-12-20(34-19(18)2)16-21-17-25(36-24-9-7-8-22(28(24)41-4)23-13-14-39(3)38-23)27-30(35-21)40(31(37-27)29(32)33)26-10-5-6-15-42-26;1-31-10-9-14(30-31)13-6-5-7-15(20(13)33-2)27-16-12-17(24)28-22-19(16)29-23(21(25)26)32(22)18-8-3-4-11-34-18;13-6-5-7(14)17-11-9(6)18-12(10(15)16)19(11)8-3-1-2-4-20-8;1-14-7-6-10(13-14)8-4-3-5-9(12)11(8)15-2;1-5-3-4-7(8)9-6(5)2/h7-9,11-14,17,26,29H,5-6,10,15-16H2,1-4H3,(H,35,36);5-7,9-10,12,18,21H,3-4,8,11H2,1-2H3,(H,27,28);5,8,10H,1-4H2;3-7H,12H2,1-2H3;3-4H,1-2H3,(H2,8,9)
• InChIKey: NSOQMBYFMKDGSN-UHFFFAOYSA-N
• XLogP: 20.03
• TPSA: 302.85 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 27
• Rotatable Bonds: 18
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1710.13
LogP ≤ 5	20.03
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	27

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-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline?

The IUPAC name of 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline (CID 159873258) is 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline.

What is the SMILES notation for 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline?

The canonical SMILES for 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline is COc1c(N)cccc1-c1ccn(C)n1.COc1c(Nc2cc(Cc3ccc(C)c(C)n3)nc3c2nc(C(F)F)n3C2CCCCO2)cccc1-c1ccn(C)n1.COc1c(Nc2cc(Cl)nc3c2nc(C(F)F)n3C2CCCCO2)cccc1-c1ccn(C)n1.Cc1ccc(N)nc1C.FC(F)c1nc2c(Cl)cc(Cl)nc2n1C1CCCCO1.

What is the InChIKey of 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline?

The InChIKey is NSOQMBYFMKDGSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33F2N7O2.C23H23ClF2N6O2.C12H11Cl2F2N3O.C11H13N3O.C7H10N2/c1-18-11-12-20(34-19(18)2)16-21-17-25(36-24-9-7-8-22(28(24)41-4)23-13-14-39(3)38-23)27-30(35-21)40(31(37-27)29(32)33)26-10-5-6-15-42-26;1-31-10-9-14(30-31)13-6-5-7-15(20(13)33-2)27-16-12-17(24)28-22-19(16)29-23(21(25)26)32(22)18-8-3-4-11-34-18;13-6-5-7(14)17-11-9(6)18-12(10(15)16)19(11)8-3-1-2-4-20-8;1-14-7-6-10(13-14)8-4-3-5-9(12)11(8)15-2;1-5-3-4-7(8)9-6(5)2/h7-9,11-14,17,26,29H,5-6,10,15-16H2,1-4H3,(H,35,36);5-7,9-10,12,18,21H,3-4,8,11H2,1-2H3,(H,27,28);5,8,10H,1-4H2;3-7H,12H2,1-2H3;3-4H,1-2H3,(H2,8,9).

What are the key properties of 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline?

5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline has a molecular weight of 1710.13 g/mol, XLogP of 20.03, 18 rotatable bonds, 4 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-2-(difluoromethyl)-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-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;2-(difluoromethyl)-5-[(5,6-dimethyl-2-pyridinyl)methyl]-N-[2-methoxy-3-(1-methylpyrazol-3-yl)phenyl]-3-(oxan-2-yl)imidazo[4,5-b]pyridin-7-amine;5,6-dimethylpyridin-2-amine;2-methoxy-3-(1-methylpyrazol-3-yl)aniline is sourced from PubChem (CID 159873258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).