N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide

C16H14N4O3S — CID 52934738

IUPACN-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
SMILESCc1cccc(S(=O)(=O)n2cc(NC(=O)c3ccccn3)cn2)c1
InChIInChI=1S/C16H14N4O3S/c1-12-5-4-6-14(9-12)24(22,23)20-11-13(10-18-20)19-16(21)15-7-2-3-8-17-15/h2-11H,1H3,(H,19,21)
InChIKeyAWEXOUBZDKRZHQ-UHFFFAOYSA-N
MW342.38 g/mol
LogP2.08
Rot. Bonds4

About N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide

N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide (PubChem CID 52934738) has the molecular formula C16H14N4O3S and a molecular weight of 342.38 g/mol. Its IUPAC name is N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
PubChem CID52934738
Molecular FormulaC16H14N4O3S
Molecular Weight342.38 g/mol
Exact Mass342.08
IUPAC NameN-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide
SMILESCc1cccc(S(=O)(=O)n2cc(NC(=O)c3ccccn3)cn2)c1
InChIInChI=1S/C16H14N4O3S/c1-12-5-4-6-14(9-12)24(22,23)20-11-13(10-18-20)19-16(21)15-7-2-3-8-17-15/h2-11H,1H3,(H,19,21)
InChIKeyAWEXOUBZDKRZHQ-UHFFFAOYSA-N
XLogP2.08
TPSA93.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

CID 711634
CID 711634
CID 11059945
CID 11059945
CID 826943
CID 826943
CID 52913659
CID 52913659
CID 52913660
CID 52913660
CID 52913768
CID 52913768
CID 52913772
CID 52913772
CID 52913885
CID 52913885
CID 52914100
CID 52914100
CID 52914105
CID 52914105
CID 52914548
CID 52914548
CID 52914664
CID 52914664

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide (CID 52934738) is N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide is Cc1cccc(S(=O)(=O)n2cc(NC(=O)c3ccccn3)cn2)c1.
What is the InChIKey of N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
The InChIKey is AWEXOUBZDKRZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O3S/c1-12-5-4-6-14(9-12)24(22,23)20-11-13(10-18-20)19-16(21)15-7-2-3-8-17-15/h2-11H,1H3,(H,19,21).
What are the key properties of N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide?
N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide has a molecular weight of 342.38 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylphenyl)sulfonylpyrazol-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 52934738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).