4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide

C133H113Cl8F7N30O7 — CID 160951134

About 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide

4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 160951134) has the molecular formula C133H113Cl8F7N30O7 and a molecular weight of 2660.18 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
• PubChem CID: 160951134
• Molecular Formula: C133H113Cl8F7N30O7
• Molecular Weight: 2660.18 g/mol
• Exact Mass: 2654.68
• IUPAC Name: 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
• SMILES: COc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)c1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3cc(C)cc(C)n3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3ccc(C(C)(F)F)nc3)c2Cl)cc1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C(F)(F)F)cc4)cnc32)n1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)n1.Cc1nn(Cc2ccc(C(C)(F)F)nc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12
• InChI: InChI=1S/C23H20ClF2N5O.C23H22ClN5O.C22H17Cl2F2N5O.C22H17ClF3N5O.C22H20ClN5O2.C21H17Cl2N5O/c1-13-4-7-16(8-5-13)29-22(32)17-11-28-21-19(20(17)24)14(2)30-31(21)12-15-6-9-18(27-10-15)23(3,25)26;1-13-5-7-17(8-6-13)27-23(30)19-11-25-22-20(21(19)24)16(4)28-29(22)12-18-10-14(2)9-15(3)26-18;1-12-18-19(24)16(21(32)29-15-6-4-14(23)5-7-15)10-28-20(18)31(30-12)11-13-3-8-17(27-9-13)22(2,25)26;1-12-4-3-5-16(28-12)11-31-20-18(13(2)30-31)19(23)17(10-27-20)21(32)29-15-8-6-14(7-9-15)22(24,25)26;1-13-4-6-16(7-5-13)26-22(29)18-11-25-21-19(20(18)23)14(2)27-28(21)12-15-8-17(30-3)10-24-9-15;1-12-4-3-5-16(25-12)11-28-20-18(13(2)27-28)19(23)17(10-24-20)21(29)26-15-8-6-14(22)7-9-15/h4-11H,12H2,1-3H3,(H,29,32);5-11H,12H2,1-4H3,(H,27,30);2*3-10H,11H2,1-2H3,(H,29,32);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29)
• InChIKey: SVTVGXMSPGTASE-UHFFFAOYSA-N
• XLogP: 31.25
• TPSA: 445.43 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 31
• Rotatable Bonds: 27
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2660.18
LogP ≤ 5	31.25
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

The IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide (CID 160951134) is 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide.

What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide is COc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)c1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3cc(C)cc(C)n3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3ccc(C(C)(F)F)nc3)c2Cl)cc1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C(F)(F)F)cc4)cnc32)n1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)n1.Cc1nn(Cc2ccc(C(C)(F)F)nc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.

What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

The InChIKey is SVTVGXMSPGTASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClF2N5O.C23H22ClN5O.C22H17Cl2F2N5O.C22H17ClF3N5O.C22H20ClN5O2.C21H17Cl2N5O/c1-13-4-7-16(8-5-13)29-22(32)17-11-28-21-19(20(17)24)14(2)30-31(21)12-15-6-9-18(27-10-15)23(3,25)26;1-13-5-7-17(8-6-13)27-23(30)19-11-25-22-20(21(19)24)16(4)28-29(22)12-18-10-14(2)9-15(3)26-18;1-12-18-19(24)16(21(32)29-15-6-4-14(23)5-7-15)10-28-20(18)31(30-12)11-13-3-8-17(27-9-13)22(2,25)26;1-12-4-3-5-16(28-12)11-31-20-18(13(2)30-31)19(23)17(10-27-20)21(32)29-15-8-6-14(7-9-15)22(24,25)26;1-13-4-6-16(7-5-13)26-22(29)18-11-25-21-19(20(18)23)14(2)27-28(21)12-15-8-17(30-3)10-24-9-15;1-12-4-3-5-16(25-12)11-28-20-18(13(2)27-28)19(23)17(10-24-20)21(29)26-15-8-6-14(22)7-9-15/h4-11H,12H2,1-3H3,(H,29,32);5-11H,12H2,1-4H3,(H,27,30);2*3-10H,11H2,1-2H3,(H,29,32);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29).

What are the key properties of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 2660.18 g/mol, XLogP of 31.25, 27 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(4,6-dimethyl-2-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 160951134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).