N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide

C11H12N4O3S — CID 63080493

IUPACN-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
SMILESCc1cc(S(N)(=O)=O)ccc1NC(=O)c1cn[nH]c1
InChIInChI=1S/C11H12N4O3S/c1-7-4-9(19(12,17)18)2-3-10(7)15-11(16)8-5-13-14-6-8/h2-6H,1H3,(H,13,14)(H,15,16)(H2,12,17,18)
InChIKeyLXNCLRZXFIXASR-UHFFFAOYSA-N
MW280.31 g/mol
LogP0.62
Rot. Bonds3

About N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide

N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide (PubChem CID 63080493) has the molecular formula C11H12N4O3S and a molecular weight of 280.31 g/mol. Its IUPAC name is N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
PubChem CID63080493
Molecular FormulaC11H12N4O3S
Molecular Weight280.31 g/mol
Exact Mass280.06
IUPAC NameN-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
SMILESCc1cc(S(N)(=O)=O)ccc1NC(=O)c1cn[nH]c1
InChIInChI=1S/C11H12N4O3S/c1-7-4-9(19(12,17)18)2-3-10(7)15-11(16)8-5-13-14-6-8/h2-6H,1H3,(H,13,14)(H,15,16)(H2,12,17,18)
InChIKeyLXNCLRZXFIXASR-UHFFFAOYSA-N
XLogP0.62
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 50.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
CID 43246544
5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
CID 104786047
N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-5-carboxamide
CID 63080492
N-(4-chloro-2-methylphenyl)-4-sulfamoylbenzamide
CID 26698295
N-(2,6-difluoro-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
CID 63078897
4-methyl-3-(1H-pyrazole-4-carbonylamino)benzoic acid
CID 43565594
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
CID 43134081
2,5-dichloro-N-(2-methyl-4-sulfamoylphenyl)thiophene-3-carboxamide
CID 107965296
N-(2-bromo-5-chloro-4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 104724206
N-(4-amino-2-methoxyphenyl)-1H-pyrazole-4-carboxamide
CID 63085782
2,5-dibromo-N-(2-methyl-4-sulfamoylphenyl)thiophene-3-carboxamide
CID 107965297

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide (CID 63080493) is N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide is Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cn[nH]c1.
What is the InChIKey of N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide?
The InChIKey is LXNCLRZXFIXASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3S/c1-7-4-9(19(12,17)18)2-3-10(7)15-11(16)8-5-13-14-6-8/h2-6H,1H3,(H,13,14)(H,15,16)(H2,12,17,18).
What are the key properties of N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide?
N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide has a molecular weight of 280.31 g/mol, XLogP of 0.62, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63080493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).