N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide

C116H115F5N28O18S4 — CID 159301060

About N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide

N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 159301060) has the molecular formula C116H115F5N28O18S4 and a molecular weight of 2412.63 g/mol. Its IUPAC name is N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide
• PubChem CID: 159301060
• Molecular Formula: C116H115F5N28O18S4
• Molecular Weight: 2412.63 g/mol
• Exact Mass: 2410.77
• IUPAC Name: N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide
• SMILES: CC(=O)NCC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CCOC(=O)Cn1ccc([C@H](CC)NC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)n1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(S(C)(=O)=O)o1.COCCN(C)CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CS(=O)(=O)c1cc([C@H](CCN)NC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)ccn1
• InChI: InChI=1S/C26H29FN6O4S.C24H23FN6O4S.C23H23FN6O3.C22H21FN6O3S.C21H19FN4O4S/c1-32(12-13-37-2)11-9-23(18-8-10-29-25(14-18)38(3,35)36)31-26(34)22-15-28-17-24-21(22)16-30-33(24)20-6-4-19(27)5-7-20;1-15(32)27-10-8-21(16-7-9-28-23(11-16)36(2,34)35)30-24(33)20-12-26-14-22-19(20)13-29-31(22)18-5-3-17(25)4-6-18;1-3-19(20-9-10-29(28-20)14-22(31)33-4-2)27-23(32)18-11-25-13-21-17(18)12-26-30(21)16-7-5-15(24)6-8-16;1-33(31,32)21-10-14(7-9-26-21)19(6-8-24)28-22(30)18-11-25-13-20-17(18)12-27-29(20)16-4-2-15(23)3-5-16;1-3-17(19-8-9-20(30-19)31(2,28)29)25-21(27)16-10-23-12-18-15(16)11-24-26(18)14-6-4-13(22)5-7-14/h4-8,10,14-17,23H,9,11-13H2,1-3H3,(H,31,34);3-7,9,11-14,21H,8,10H2,1-2H3,(H,27,32)(H,30,33);5-13,19H,3-4,14H2,1-2H3,(H,27,32);2-5,7,9-13,19H,6,8,24H2,1H3,(H,28,30);4-12,17H,3H2,1-2H3,(H,25,27)/t23-;21-;2*19-;17-/m00000/s1
• InChIKey: LBINKMGYMHJVGV-URWCJLCHSA-N
• XLogP: 13.97
• TPSA: 599.13 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 40
• Rotatable Bonds: 40
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2412.63
LogP ≤ 5	13.97
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The IUPAC name of N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide (CID 159301060) is N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

What is the SMILES notation for N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The canonical SMILES for N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide is CC(=O)NCC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CCOC(=O)Cn1ccc([C@H](CC)NC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)n1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(S(C)(=O)=O)o1.COCCN(C)CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CS(=O)(=O)c1cc([C@H](CCN)NC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)ccn1.

What is the InChIKey of N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The InChIKey is LBINKMGYMHJVGV-URWCJLCHSA-N. The full InChI is InChI=1S/C26H29FN6O4S.C24H23FN6O4S.C23H23FN6O3.C22H21FN6O3S.C21H19FN4O4S/c1-32(12-13-37-2)11-9-23(18-8-10-29-25(14-18)38(3,35)36)31-26(34)22-15-28-17-24-21(22)16-30-33(24)20-6-4-19(27)5-7-20;1-15(32)27-10-8-21(16-7-9-28-23(11-16)36(2,34)35)30-24(33)20-12-26-14-22-19(20)13-29-31(22)18-5-3-17(25)4-6-18;1-3-19(20-9-10-29(28-20)14-22(31)33-4-2)27-23(32)18-11-25-13-21-17(18)12-26-30(21)16-7-5-15(24)6-8-16;1-33(31,32)21-10-14(7-9-26-21)19(6-8-24)28-22(30)18-11-25-13-20-17(18)12-27-29(20)16-4-2-15(23)3-5-16;1-3-17(19-8-9-20(30-19)31(2,28)29)25-21(27)16-10-23-12-18-15(16)11-24-26(18)14-6-4-13(22)5-7-14/h4-8,10,14-17,23H,9,11-13H2,1-3H3,(H,31,34);3-7,9,11-14,21H,8,10H2,1-2H3,(H,27,32)(H,30,33);5-13,19H,3-4,14H2,1-2H3,(H,27,32);2-5,7,9-13,19H,6,8,24H2,1H3,(H,28,30);4-12,17H,3H2,1-2H3,(H,25,27)/t23-;21-;2*19-;17-/m00000/s1.

What are the key properties of N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 2412.63 g/mol, XLogP of 13.97, 40 rotatable bonds, 7 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1S)-3-acetamido-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;ethyl 2-[3-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyrazol-1-yl]acetate;1-(4-fluorophenyl)-N-[(1S)-3-[2-methoxyethyl(methyl)amino]-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonylfuran-2-yl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 159301060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).