N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide

C120H117BrF5N29O11S2 — CID 159704131

About N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide

N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 159704131) has the molecular formula C120H117BrF5N29O11S2 and a molecular weight of 2380.48 g/mol. Its IUPAC name is N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide
• PubChem CID: 159704131
• Molecular Formula: C120H117BrF5N29O11S2
• Molecular Weight: 2380.48 g/mol
• Exact Mass: 2377.80
• IUPAC Name: N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide
• SMILES: CC(C)(NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(Br)c1.CC(C)(NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(N(C)CCOC)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(N2CCN(C(C)=O)CC2)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(N2CCS(=O)(=O)CC2)c1
• InChI: InChI=1S/C27H28FN7O2.C25H25FN6O3S.C25H27FN6O2.C22H20FN5O3S.C21H17BrFN5O/c1-3-24(19-8-9-30-26(14-19)34-12-10-33(11-13-34)18(2)36)32-27(37)23-15-29-17-25-22(23)16-31-35(25)21-6-4-20(28)5-7-21;1-2-22(17-7-8-28-24(13-17)31-9-11-36(34,35)12-10-31)30-25(33)21-14-27-16-23-20(21)15-29-32(23)19-5-3-18(26)4-6-19;1-4-22(17-9-10-28-24(13-17)31(2)11-12-34-3)30-25(33)21-14-27-16-23-20(21)15-29-32(23)19-7-5-18(26)6-8-19;1-22(2,14-8-9-25-20(10-14)32(3,30)31)27-21(29)18-11-24-13-19-17(18)12-26-28(19)16-6-4-15(23)5-7-16;1-21(2,13-7-8-25-19(22)9-13)27-20(29)17-10-24-12-18-16(17)11-26-28(18)15-5-3-14(23)4-6-15/h4-9,14-17,24H,3,10-13H2,1-2H3,(H,32,37);3-8,13-16,22H,2,9-12H2,1H3,(H,30,33);5-10,13-16,22H,4,11-12H2,1-3H3,(H,30,33);4-13H,1-3H3,(H,27,29);3-12H,1-2H3,(H,27,29)/t24-;2*22-;;/m000../s1
• InChIKey: MXZMZQPAIXUXLF-XXCLVPSUSA-N
• XLogP: 17.90
• TPSA: 471.04 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 34
• Rotatable Bonds: 30
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2380.48
LogP ≤ 5	17.90
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	34

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-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The IUPAC name of N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide (CID 159704131) is N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide.

What is the SMILES notation for N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The canonical SMILES for N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide is CC(C)(NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(Br)c1.CC(C)(NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(N(C)CCOC)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(N2CCN(C(C)=O)CC2)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(N2CCS(=O)(=O)CC2)c1.

What is the InChIKey of N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The InChIKey is MXZMZQPAIXUXLF-XXCLVPSUSA-N. The full InChI is InChI=1S/C27H28FN7O2.C25H25FN6O3S.C25H27FN6O2.C22H20FN5O3S.C21H17BrFN5O/c1-3-24(19-8-9-30-26(14-19)34-12-10-33(11-13-34)18(2)36)32-27(37)23-15-29-17-25-22(23)16-31-35(25)21-6-4-20(28)5-7-21;1-2-22(17-7-8-28-24(13-17)31-9-11-36(34,35)12-10-31)30-25(33)21-14-27-16-23-20(21)15-29-32(23)19-5-3-18(26)4-6-19;1-4-22(17-9-10-28-24(13-17)31(2)11-12-34-3)30-25(33)21-14-27-16-23-20(21)15-29-32(23)19-7-5-18(26)6-8-19;1-22(2,14-8-9-25-20(10-14)32(3,30)31)27-21(29)18-11-24-13-19-17(18)12-26-28(19)16-6-4-15(23)5-7-16;1-21(2,13-7-8-25-19(22)9-13)27-20(29)17-10-24-12-18-16(17)11-26-28(18)15-5-3-14(23)4-6-15/h4-9,14-17,24H,3,10-13H2,1-2H3,(H,32,37);3-8,13-16,22H,2,9-12H2,1H3,(H,30,33);5-10,13-16,22H,4,11-12H2,1-3H3,(H,30,33);4-13H,1-3H3,(H,27,29);3-12H,1-2H3,(H,27,29)/t24-;2*22-;;/m000../s1.

What are the key properties of N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?

N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 2380.48 g/mol, XLogP of 17.90, 30 rotatable bonds, 5 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1S)-1-[2-(4-acetylpiperazin-1-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[2-(2-bromo-4-pyridinyl)propan-2-yl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-4-pyridinyl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-[2-[2-methoxyethyl(methyl)amino]-4-pyridinyl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 159704131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).