1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate

C108H98F5N27O13S3 — CID 162054999

About 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate

1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate (PubChem CID 162054999) has the molecular formula C108H98F5N27O13S3 and a molecular weight of 2173.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate.

Molecular Properties

• Compound Name: 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate
• PubChem CID: 162054999
• Molecular Formula: C108H98F5N27O13S3
• Molecular Weight: 2173.34 g/mol
• Exact Mass: 2171.69
• IUPAC Name: 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate
• SMILES: CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(S(C)(=O)=O)ccn1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cccc(S(=O)(=O)CCC(=O)OC)n1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cccc(S(N)(=O)=O)n1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(C)c1.Cn1cc(CNC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)cn1
• InChI: InChI=1S/C25H24FN5O5S.C22H20FN5O3S.C22H20FN5O.C21H19FN6O3S.C18H15FN6O/c1-3-20(21-5-4-6-23(29-21)37(34,35)12-11-24(32)36-2)30-25(33)19-13-27-15-22-18(19)14-28-31(22)17-9-7-16(26)8-10-17;1-3-19(20-10-16(8-9-25-20)32(2,30)31)27-22(29)18-11-24-13-21-17(18)12-26-28(21)15-6-4-14(23)5-7-15;1-3-20(15-8-9-25-14(2)10-15)27-22(29)19-11-24-13-21-18(19)12-26-28(21)17-6-4-16(23)5-7-17;1-2-17(18-4-3-5-20(26-18)32(23,30)31)27-21(29)16-10-24-12-19-15(16)11-25-28(19)14-8-6-13(22)7-9-14;1-24-11-12(7-22-24)6-21-18(26)16-8-20-10-17-15(16)9-23-25(17)14-4-2-13(19)3-5-14/h4-10,13-15,20H,3,11-12H2,1-2H3,(H,30,33);4-13,19H,3H2,1-2H3,(H,27,29);4-13,20H,3H2,1-2H3,(H,27,29);3-12,17H,2H2,1H3,(H,27,29)(H2,23,30,31);2-5,7-11H,6H2,1H3,(H,21,26)/t20-;19-;20-;17-;/m0000./s1
• InChIKey: YZBCMVCICWNMLH-RIRFDIQDSA-N
• XLogP: 15.26
• TPSA: 523.17 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 34
• Rotatable Bonds: 30
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2173.34
LogP ≤ 5	15.26
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate?

The IUPAC name of 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate (CID 162054999) is 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate.

What is the SMILES notation for 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate?

The canonical SMILES for 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate is CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(S(C)(=O)=O)ccn1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cccc(S(=O)(=O)CCC(=O)OC)n1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cccc(S(N)(=O)=O)n1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(C)c1.Cn1cc(CNC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)cn1.

What is the InChIKey of 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate?

The InChIKey is YZBCMVCICWNMLH-RIRFDIQDSA-N. The full InChI is InChI=1S/C25H24FN5O5S.C22H20FN5O3S.C22H20FN5O.C21H19FN6O3S.C18H15FN6O/c1-3-20(21-5-4-6-23(29-21)37(34,35)12-11-24(32)36-2)30-25(33)19-13-27-15-22-18(19)14-28-31(22)17-9-7-16(26)8-10-17;1-3-19(20-10-16(8-9-25-20)32(2,30)31)27-22(29)18-11-24-13-21-17(18)12-26-28(21)15-6-4-14(23)5-7-15;1-3-20(15-8-9-25-14(2)10-15)27-22(29)19-11-24-13-21-18(19)12-26-28(21)17-6-4-16(23)5-7-17;1-2-17(18-4-3-5-20(26-18)32(23,30)31)27-21(29)16-10-24-12-19-15(16)11-25-28(19)14-8-6-13(22)7-9-14;1-24-11-12(7-22-24)6-21-18(26)16-8-20-10-17-15(16)9-23-25(17)14-4-2-13(19)3-5-14/h4-10,13-15,20H,3,11-12H2,1-2H3,(H,30,33);4-13,19H,3H2,1-2H3,(H,27,29);4-13,20H,3H2,1-2H3,(H,27,29);3-12,17H,2H2,1H3,(H,27,29)(H2,23,30,31);2-5,7-11H,6H2,1H3,(H,21,26)/t20-;19-;20-;17-;/m0000./s1.

What are the key properties of 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate?

1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate has a molecular weight of 2173.34 g/mol, XLogP of 15.26, 30 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-fluorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methylsulfonyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate is sourced from PubChem (CID 162054999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).