1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide

C22H20FN5O3S — CID 59278307

IUPAC1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCC(C)(NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1
InChIInChI=1S/C22H20FN5O3S/c1-22(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/h4-13H,1-3H3,(H,27,29)
InChIKeyQVTLLMLUTLGKQL-UHFFFAOYSA-N
MW453.50 g/mol
LogP3.02
Rot. Bonds5

About 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]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 59278307) has the molecular formula C22H20FN5O3S and a molecular weight of 453.50 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide
PubChem CID59278307
Molecular FormulaC22H20FN5O3S
Molecular Weight453.50 g/mol
Exact Mass453.13
IUPAC Name1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide
SMILESCC(C)(NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1
InChIInChI=1S/C22H20FN5O3S/c1-22(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/h4-13H,1-3H3,(H,27,29)
InChIKeyQVTLLMLUTLGKQL-UHFFFAOYSA-N
XLogP3.02
TPSA106.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.50
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide (CID 59278307) is 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 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?
The canonical SMILES for 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(S(C)(=O)=O)c1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide?
The InChIKey is QVTLLMLUTLGKQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN5O3S/c1-22(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/h4-13H,1-3H3,(H,27,29).
What are the key properties of 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]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 453.50 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[2-(2-methylsulfonyl-4-pyridinyl)propan-2-yl]pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 59278307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).