N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid

C114H100Br2F5N23O13S — CID 161378604

About N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid

N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid (PubChem CID 161378604) has the molecular formula C114H100Br2F5N23O13S and a molecular weight of 2287.07 g/mol. Its IUPAC name is N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid
• PubChem CID: 161378604
• Molecular Formula: C114H100Br2F5N23O13S
• Molecular Weight: 2287.07 g/mol
• Exact Mass: 2283.59
• IUPAC Name: N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid
• SMILES: CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(OC)c(Br)c1.CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(OC)c(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(OC)c(Br)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(C(=O)O)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(C(N)=O)c1
• InChI: InChI=1S/C24H23FN4O4S.2C23H20BrFN4O2.C22H19FN6O2.C22H18FN5O3/c1-4-20(15-5-10-22(33-2)23(11-15)34(3,31)32)28-24(30)19-12-26-14-21-18(19)13-27-29(21)17-8-6-16(25)7-9-17;2*1-3-20(14-4-9-22(31-2)19(24)10-14)28-23(30)18-11-26-13-21-17(18)12-27-29(21)16-7-5-15(25)6-8-16;1-2-18(13-7-8-26-19(9-13)21(24)30)28-22(31)17-10-25-12-20-16(17)11-27-29(20)15-5-3-14(23)4-6-15;1-2-18(13-7-8-25-19(9-13)22(30)31)27-21(29)17-10-24-12-20-16(17)11-26-28(20)15-5-3-14(23)4-6-15/h5-14,20H,4H2,1-3H3,(H,28,30);2*4-13,20H,3H2,1-2H3,(H,28,30);3-12,18H,2H2,1H3,(H2,24,30)(H,28,31);3-12,18H,2H2,1H3,(H,27,29)(H,30,31)/t3*20-;2*18-/m11000/s1
• InChIKey: VRKIUVHVKPZKTG-GNHJGELDSA-N
• XLogP: 20.74
• TPSA: 467.05 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 31
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2287.07
LogP ≤ 5	20.74
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid?

The IUPAC name of N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid (CID 161378604) is N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid.

What is the SMILES notation for N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid?

The canonical SMILES for N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid is CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(OC)c(Br)c1.CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(OC)c(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccc(OC)c(Br)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(C(=O)O)c1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(C(N)=O)c1.

What is the InChIKey of N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid?

The InChIKey is VRKIUVHVKPZKTG-GNHJGELDSA-N. The full InChI is InChI=1S/C24H23FN4O4S.2C23H20BrFN4O2.C22H19FN6O2.C22H18FN5O3/c1-4-20(15-5-10-22(33-2)23(11-15)34(3,31)32)28-24(30)19-12-26-14-21-18(19)13-27-29(21)17-8-6-16(25)7-9-17;2*1-3-20(14-4-9-22(31-2)19(24)10-14)28-23(30)18-11-26-13-21-17(18)12-27-29(21)16-7-5-15(25)6-8-16;1-2-18(13-7-8-26-19(9-13)21(24)30)28-22(31)17-10-25-12-20-16(17)11-27-29(20)15-5-3-14(23)4-6-15;1-2-18(13-7-8-25-19(9-13)22(30)31)27-21(29)17-10-24-12-20-16(17)11-26-28(20)15-5-3-14(23)4-6-15/h5-14,20H,4H2,1-3H3,(H,28,30);2*4-13,20H,3H2,1-2H3,(H,28,30);3-12,18H,2H2,1H3,(H2,24,30)(H,28,31);3-12,18H,2H2,1H3,(H,27,29)(H,30,31)/t3*20-;2*18-/m11000/s1.

What are the key properties of N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid?

N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid has a molecular weight of 2287.07 g/mol, XLogP of 20.74, 31 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(3-bromo-4-methoxyphenyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(2-carbamoyl-4-pyridinyl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-(4-methoxy-3-methylsulfonylphenyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;4-[(1S)-1-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]propyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 161378604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).