N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide

C112H93BrF5N25O12S3 — CID 158933630

About N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide

N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 158933630) has the molecular formula C112H93BrF5N25O12S3 and a molecular weight of 2252.23 g/mol. Its IUPAC name is N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide
• PubChem CID: 158933630
• Molecular Formula: C112H93BrF5N25O12S3
• Molecular Weight: 2252.23 g/mol
• Exact Mass: 2249.57
• IUPAC Name: N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide
• SMILES: COc1ccc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CCC2)cc1.CS(=O)(=O)c1cc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CCC2)ccn1.NS(=O)(=O)c1ccc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CC2)cn1.NS(=O)(=O)c1cccc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CC2)c1.O=C(NC1(c2ccnc(Br)c2)CCC1)c1cncc2c1cnn2-c1ccc(F)cc1
• InChI: InChI=1S/C24H21FN4O2.C23H20FN5O3S.C22H17BrFN5O.C22H18FN5O3S.C21H17FN6O3S/c1-31-19-9-3-16(4-10-19)24(11-2-12-24)28-23(30)21-13-26-15-22-20(21)14-27-29(22)18-7-5-17(25)6-8-18;1-33(31,32)21-11-15(7-10-26-21)23(8-2-9-23)28-22(30)19-12-25-14-20-18(19)13-27-29(20)17-5-3-16(24)4-6-17;23-20-10-14(6-9-26-20)22(7-1-8-22)28-21(30)18-11-25-13-19-17(18)12-27-29(19)16-4-2-15(24)3-5-16;23-15-4-6-16(7-5-15)28-20-13-25-11-19(18(20)12-26-28)21(29)27-22(8-9-22)14-2-1-3-17(10-14)32(24,30)31;22-14-2-4-15(5-3-14)28-18-12-24-10-17(16(18)11-26-28)20(29)27-21(7-8-21)13-1-6-19(25-9-13)32(23,30)31/h3-10,13-15H,2,11-12H2,1H3,(H,28,30);3-7,10-14H,2,8-9H2,1H3,(H,28,30);2-6,9-13H,1,7-8H2,(H,28,30);1-7,10-13H,8-9H2,(H,27,29)(H2,24,30,31);1-6,9-12H,7-8H2,(H,27,29)(H2,23,30,31)
• InChIKey: JJJKTNAJMKQDNH-UHFFFAOYSA-N
• XLogP: 16.72
• TPSA: 501.41 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 30
• Rotatable Bonds: 24
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2252.23
LogP ≤ 5	16.72
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The IUPAC name of N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide (CID 158933630) is N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

What is the SMILES notation for N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The canonical SMILES for N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide is COc1ccc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CCC2)cc1.CS(=O)(=O)c1cc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CCC2)ccn1.NS(=O)(=O)c1ccc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CC2)cn1.NS(=O)(=O)c1cccc(C2(NC(=O)c3cncc4c3cnn4-c3ccc(F)cc3)CC2)c1.O=C(NC1(c2ccnc(Br)c2)CCC1)c1cncc2c1cnn2-c1ccc(F)cc1.

What is the InChIKey of N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The InChIKey is JJJKTNAJMKQDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN4O2.C23H20FN5O3S.C22H17BrFN5O.C22H18FN5O3S.C21H17FN6O3S/c1-31-19-9-3-16(4-10-19)24(11-2-12-24)28-23(30)21-13-26-15-22-20(21)14-27-29(22)18-7-5-17(25)6-8-18;1-33(31,32)21-11-15(7-10-26-21)23(8-2-9-23)28-22(30)19-12-25-14-20-18(19)13-27-29(20)17-5-3-16(24)4-6-17;23-20-10-14(6-9-26-20)22(7-1-8-22)28-21(30)18-11-25-13-19-17(18)12-27-29(19)16-4-2-15(24)3-5-16;23-15-4-6-16(7-5-15)28-20-13-25-11-19(18(20)12-26-28)21(29)27-22(8-9-22)14-2-1-3-17(10-14)32(24,30)31;22-14-2-4-15(5-3-14)28-18-12-24-10-17(16(18)11-26-28)20(29)27-21(7-8-21)13-1-6-19(25-9-13)32(23,30)31/h3-10,13-15H,2,11-12H2,1H3,(H,28,30);3-7,10-14H,2,8-9H2,1H3,(H,28,30);2-6,9-13H,1,7-8H2,(H,28,30);1-7,10-13H,8-9H2,(H,27,29)(H2,24,30,31);1-6,9-12H,7-8H2,(H,27,29)(H2,23,30,31).

What are the key properties of N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 2252.23 g/mol, XLogP of 16.72, 24 rotatable bonds, 7 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(2-bromo-4-pyridinyl)cyclobutyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(4-methoxyphenyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(2-methylsulfonyl-4-pyridinyl)cyclobutyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(3-sulfamoylphenyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[1-(6-sulfamoyl-3-pyridinyl)cyclopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 158933630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).