N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide

C13H13N3O4S — CID 103763936

IUPACN-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCNS(=O)(=O)c1cccc(NC(=O)c2cc[nH]c(=O)c2)c1
InChIInChI=1S/C13H13N3O4S/c1-14-21(19,20)11-4-2-3-10(8-11)16-13(18)9-5-6-15-12(17)7-9/h2-8,14H,1H3,(H,15,17)(H,16,18)
InChIKeyWRQUEZQMKQBDRH-UHFFFAOYSA-N
MW307.33 g/mol
LogP0.54
Rot. Bonds4

About N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide

N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103763936) has the molecular formula C13H13N3O4S and a molecular weight of 307.33 g/mol. Its IUPAC name is N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103763936
Molecular FormulaC13H13N3O4S
Molecular Weight307.33 g/mol
Exact Mass307.06
IUPAC NameN-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCNS(=O)(=O)c1cccc(NC(=O)c2cc[nH]c(=O)c2)c1
InChIInChI=1S/C13H13N3O4S/c1-14-21(19,20)11-4-2-3-10(8-11)16-13(18)9-5-6-15-12(17)7-9/h2-8,14H,1H3,(H,15,17)(H,16,18)
InChIKeyWRQUEZQMKQBDRH-UHFFFAOYSA-N
XLogP0.54
TPSA108.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[3-(methylsulfamoyl)phenyl]benzamide
CID 60755899
N-[3-(methylsulfamoyl)phenyl]-3-oxobutanamide
CID 61251053
N-[3-(4-tert-butylbenzoyl)phenyl]-3-(methylsulfamoyl)benzamide
CID 100621284
N-(3-chlorophenyl)-4-(methylsulfamoyl)benzamide
CID 34742954
5-bromo-N-[3-(methylsulfamoyl)phenyl]furan-2-carboxamide
CID 47175858
methyl 4-[[3-(methylsulfamoyl)benzoyl]amino]benzoate
CID 26583048
N-(3-bromophenyl)-4-(methylsulfamoyl)benzamide
CID 17459459
3-amino-N-[3-(methylsulfamoyl)phenyl]-1H-1,2,4-triazole-5-carboxamide
CID 62806151
N-methyl-3-(methylamino)benzenesulfonamide
CID 63089854
2-bromo-N-[3-(methylsulfamoyl)phenyl]propanamide
CID 107903680
(2R)-2-amino-N-[3-(methylsulfamoyl)phenyl]propanamide
CID 51885688
N-(2,6-diethylphenyl)-2-oxo-1H-pyridine-4-carboxamide
CID 110600773

Frequently Asked Questions

What is the IUPAC name of N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide (CID 103763936) is N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide is CNS(=O)(=O)c1cccc(NC(=O)c2cc[nH]c(=O)c2)c1.
What is the InChIKey of N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is WRQUEZQMKQBDRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O4S/c1-14-21(19,20)11-4-2-3-10(8-11)16-13(18)9-5-6-15-12(17)7-9/h2-8,14H,1H3,(H,15,17)(H,16,18).
What are the key properties of N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide?
N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 307.33 g/mol, XLogP of 0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methylsulfamoyl)phenyl]-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103763936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).