5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide

C11H12N4O3S — CID 82589417

IUPAC5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide
SMILESCS(=O)(=O)c1cccc(-n2nc(C(N)=O)cc2N)c1
InChIInChI=1S/C11H12N4O3S/c1-19(17,18)8-4-2-3-7(5-8)15-10(12)6-9(14-15)11(13)16/h2-6H,12H2,1H3,(H2,13,16)
InChIKeyJEOSNQOKZMLLKF-UHFFFAOYSA-N
MW280.31 g/mol
LogP-0.04
Rot. Bonds3

About 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide

5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide (PubChem CID 82589417) has the molecular formula C11H12N4O3S and a molecular weight of 280.31 g/mol. Its IUPAC name is 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide
PubChem CID82589417
Molecular FormulaC11H12N4O3S
Molecular Weight280.31 g/mol
Exact Mass280.06
IUPAC Name5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide
SMILESCS(=O)(=O)c1cccc(-n2nc(C(N)=O)cc2N)c1
InChIInChI=1S/C11H12N4O3S/c1-19(17,18)8-4-2-3-7(5-8)15-10(12)6-9(14-15)11(13)16/h2-6H,12H2,1H3,(H2,13,16)
InChIKeyJEOSNQOKZMLLKF-UHFFFAOYSA-N
XLogP-0.04
TPSA121.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-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

5-methyl-2-(3-methylsulfonylphenyl)pyrazol-3-amine
CID 21455575
5-amino-1-(2,6-difluorophenyl)pyrazole-3-carboxamide
CID 82589389
5-amino-1-(3-chlorophenyl)pyrazole-3-carboxylic acid
CID 82116964
1-(4-fluorophenyl)-5-methylsulfonylpyrazole-3-carboxamide
CID 175821975
ethyl 5-amino-1-(3-methylphenyl)pyrazole-3-carboxylate
CID 75357933
5-methyl-1-phenylpyrazole-3-carboxamide
CID 68896199
1-(3-methylsulfonylphenyl)pyrrole
CID 67689461
1-(4-methoxyphenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carboxamide
CID 10523251
ethyl 5-amino-1-phenylpyrazole-3-carboxylate
CID 23630921
3-methyl-1-(3-methylsulfonylphenyl)-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 82586522
[5-amino-1-(3-methylphenyl)pyrazol-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 82188845
4-(3-methylsulfonylphenyl)piperazine-1-sulfonyl chloride
CID 75409784

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide?
The IUPAC name of 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide (CID 82589417) is 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide?
The canonical SMILES for 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide is CS(=O)(=O)c1cccc(-n2nc(C(N)=O)cc2N)c1.
What is the InChIKey of 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide?
The InChIKey is JEOSNQOKZMLLKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3S/c1-19(17,18)8-4-2-3-7(5-8)15-10(12)6-9(14-15)11(13)16/h2-6H,12H2,1H3,(H2,13,16).
What are the key properties of 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide?
5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide has a molecular weight of 280.31 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(3-methylsulfonylphenyl)pyrazole-3-carboxamide is sourced from PubChem (CID 82589417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).