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

C111H100ClF5N26O15S4 — CID 162131290

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

N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate (PubChem CID 162131290) has the molecular formula C111H100ClF5N26O15S4 and a molecular weight of 2296.90 g/mol. Its IUPAC name is N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate.

Molecular Properties

• Compound Name: N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate
• PubChem CID: 162131290
• Molecular Formula: C111H100ClF5N26O15S4
• Molecular Weight: 2296.90 g/mol
• Exact Mass: 2294.64
• IUPAC Name: N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(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)c1ccnc(Cl)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(=O)(=O)CC)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(=O)(=O)CCC(=O)OC)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.C[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cccc(S(N)(=O)=O)n1
• InChI: InChI=1S/C25H24FN5O5S.C23H22FN5O3S.C22H20FN5O3S.C21H17ClFN5O.C20H17FN6O3S/c1-3-21(16-8-10-28-23(12-16)37(34,35)11-9-24(32)36-2)30-25(33)20-13-27-15-22-19(20)14-29-31(22)18-6-4-17(26)5-7-18;1-3-20(15-9-10-26-22(11-15)33(31,32)4-2)28-23(30)19-12-25-14-21-18(19)13-27-29(21)17-7-5-16(24)6-8-17;1-3-19(14-8-9-25-21(10-14)32(2,30)31)27-22(29)18-11-24-13-20-17(18)12-26-28(20)16-6-4-15(23)5-7-16;1-2-18(13-7-8-25-20(22)9-13)27-21(29)17-10-24-12-19-16(17)11-26-28(19)15-5-3-14(23)4-6-15;1-12(17-3-2-4-19(26-17)31(22,29)30)25-20(28)16-9-23-11-18-15(16)10-24-27(18)14-7-5-13(21)6-8-14/h4-8,10,12-15,21H,3,9,11H2,1-2H3,(H,30,33);5-14,20H,3-4H2,1-2H3,(H,28,30);4-13,19H,3H2,1-2H3,(H,27,29);3-12,18H,2H2,1H3,(H,27,29);2-12H,1H3,(H,25,28)(H2,22,29,30)/t21-;20-;19-;18-;12-/m00000/s1
• InChIKey: ZIRUMLPSXHKDND-BHXRKATFSA-N
• XLogP: 16.62
• TPSA: 552.38 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 35
• Rotatable Bonds: 32
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2296.90
LogP ≤ 5	16.62
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate (CID 162131290) is N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate.

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

The canonical SMILES for N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(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)c1ccnc(Cl)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(=O)(=O)CC)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(=O)(=O)CCC(=O)OC)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.C[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cccc(S(N)(=O)=O)n1.

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

The InChIKey is ZIRUMLPSXHKDND-BHXRKATFSA-N. The full InChI is InChI=1S/C25H24FN5O5S.C23H22FN5O3S.C22H20FN5O3S.C21H17ClFN5O.C20H17FN6O3S/c1-3-21(16-8-10-28-23(12-16)37(34,35)11-9-24(32)36-2)30-25(33)20-13-27-15-22-19(20)14-29-31(22)18-6-4-17(26)5-7-18;1-3-20(15-9-10-26-22(11-15)33(31,32)4-2)28-23(30)19-12-25-14-21-18(19)13-27-29(21)17-7-5-16(24)6-8-17;1-3-19(14-8-9-25-21(10-14)32(2,30)31)27-22(29)18-11-24-13-20-17(18)12-26-28(20)16-6-4-15(23)5-7-16;1-2-18(13-7-8-25-20(22)9-13)27-21(29)17-10-24-12-19-16(17)11-26-28(19)15-5-3-14(23)4-6-15;1-12(17-3-2-4-19(26-17)31(22,29)30)25-20(28)16-9-23-11-18-15(16)10-24-27(18)14-7-5-13(21)6-8-14/h4-8,10,12-15,21H,3,9,11H2,1-2H3,(H,30,33);5-14,20H,3-4H2,1-2H3,(H,28,30);4-13,19H,3H2,1-2H3,(H,27,29);3-12,18H,2H2,1H3,(H,27,29);2-12H,1H3,(H,25,28)(H2,22,29,30)/t21-;20-;19-;18-;12-/m00000/s1.

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

N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate has a molecular weight of 2296.90 g/mol, XLogP of 16.62, 32 rotatable bonds, 6 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1S)-1-(2-chloro-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-ethylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-sulfamoyl-2-pyridinyl)ethyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]-2-pyridinyl]sulfonyl]propanoate is sourced from PubChem (CID 162131290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).