4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide

C120H110Cl7N33O7 — CID 159545416

About 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide

4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 159545416) has the molecular formula C120H110Cl7N33O7 and a molecular weight of 2374.59 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
• PubChem CID: 159545416
• Molecular Formula: C120H110Cl7N33O7
• Molecular Weight: 2374.59 g/mol
• Exact Mass: 2369.71
• IUPAC Name: 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
• SMILES: CC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3cccn3C)c2Cl)cc1.CC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3nccn3C)c2Cl)cc1.COc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccn3C)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccn3C)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3nccn3C)c2Cl)cc1.Cn1ccnc1Cn1ncc2c(Cl)c(C(=O)Nc3ccc(Cl)cc3)cnc21
• InChI: InChI=1S/C22H22ClN5O.C21H21ClN6O.C20H18ClN5O2.C20H18ClN5O.C19H17ClN6O.C18H14Cl2N6O/c1-14(2)15-6-8-16(9-7-15)26-22(29)19-11-24-21-18(20(19)23)12-25-28(21)13-17-5-4-10-27(17)3;1-13(2)14-4-6-15(7-5-14)26-21(29)17-10-24-20-16(19(17)22)11-25-28(20)12-18-23-8-9-27(18)3;1-25-9-3-4-14(25)12-26-19-16(11-23-26)18(21)17(10-22-19)20(27)24-13-5-7-15(28-2)8-6-13;1-13-5-7-14(8-6-13)24-20(27)17-10-22-19-16(18(17)21)11-23-26(19)12-15-4-3-9-25(15)2;1-12-3-5-13(6-4-12)24-19(27)15-9-22-18-14(17(15)20)10-23-26(18)11-16-21-7-8-25(16)2;1-25-7-6-21-15(25)10-26-17-13(9-23-26)16(20)14(8-22-17)18(27)24-12-4-2-11(19)3-5-12/h4-12,14H,13H2,1-3H3,(H,26,29);4-11,13H,12H2,1-3H3,(H,26,29);3-11H,12H2,1-2H3,(H,24,27);3-11H,12H2,1-2H3,(H,24,27);3-10H,11H2,1-2H3,(H,24,27);2-9H,10H2,1H3,(H,24,27)
• InChIKey: MESVJXRIBATLFH-UHFFFAOYSA-N
• XLogP: 24.05
• TPSA: 436.34 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 34
• Rotatable Bonds: 27
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2374.59
LogP ≤ 5	24.05
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

The IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide (CID 159545416) is 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide.

What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide is CC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3cccn3C)c2Cl)cc1.CC(C)c1ccc(NC(=O)c2cnc3c(cnn3Cc3nccn3C)c2Cl)cc1.COc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccn3C)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3cccn3C)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(cnn3Cc3nccn3C)c2Cl)cc1.Cn1ccnc1Cn1ncc2c(Cl)c(C(=O)Nc3ccc(Cl)cc3)cnc21.

What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

The InChIKey is MESVJXRIBATLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClN5O.C21H21ClN6O.C20H18ClN5O2.C20H18ClN5O.C19H17ClN6O.C18H14Cl2N6O/c1-14(2)15-6-8-16(9-7-15)26-22(29)19-11-24-21-18(20(19)23)12-25-28(21)13-17-5-4-10-27(17)3;1-13(2)14-4-6-15(7-5-14)26-21(29)17-10-24-20-16(19(17)22)11-25-28(20)12-18-23-8-9-27(18)3;1-25-9-3-4-14(25)12-26-19-16(11-23-26)18(21)17(10-22-19)20(27)24-13-5-7-15(28-2)8-6-13;1-13-5-7-14(8-6-13)24-20(27)17-10-22-19-16(18(17)21)11-23-26(19)12-15-4-3-9-25(15)2;1-12-3-5-13(6-4-12)24-19(27)15-9-22-18-14(17(15)20)10-23-26(18)11-16-21-7-8-25(16)2;1-25-7-6-21-15(25)10-26-17-13(9-23-26)16(20)14(8-22-17)18(27)24-12-4-2-11(19)3-5-12/h4-12,14H,13H2,1-3H3,(H,26,29);4-11,13H,12H2,1-3H3,(H,26,29);3-11H,12H2,1-2H3,(H,24,27);3-11H,12H2,1-2H3,(H,24,27);3-10H,11H2,1-2H3,(H,24,27);2-9H,10H2,1H3,(H,24,27).

What are the key properties of 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 2374.59 g/mol, XLogP of 24.05, 27 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-(4-chlorophenyl)-1-[(1-methylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylimidazol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-methylpyrrol-2-yl)methyl]-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 159545416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).