5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide

C13H12FN3O3S — CID 104786047

IUPAC5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
SMILESCc1cc(S(N)(=O)=O)ccc1NC(=O)c1cncc(F)c1
InChIInChI=1S/C13H12FN3O3S/c1-8-4-11(21(15,19)20)2-3-12(8)17-13(18)9-5-10(14)7-16-6-9/h2-7H,1H3,(H,17,18)(H2,15,19,20)
InChIKeyKZORMDFGYXYYNR-UHFFFAOYSA-N
MW309.32 g/mol
LogP1.43
Rot. Bonds3

About 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide

5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide (PubChem CID 104786047) has the molecular formula C13H12FN3O3S and a molecular weight of 309.32 g/mol. Its IUPAC name is 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
PubChem CID104786047
Molecular FormulaC13H12FN3O3S
Molecular Weight309.32 g/mol
Exact Mass309.06
IUPAC Name5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
SMILESCc1cc(S(N)(=O)=O)ccc1NC(=O)c1cncc(F)c1
InChIInChI=1S/C13H12FN3O3S/c1-8-4-11(21(15,19)20)2-3-12(8)17-13(18)9-5-10(14)7-16-6-9/h2-7H,1H3,(H,17,18)(H2,15,19,20)
InChIKeyKZORMDFGYXYYNR-UHFFFAOYSA-N
XLogP1.43
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.32
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(5-fluoropyridine-3-carbonyl)amino]-3-methylbenzenesulfonyl chloride
CID 104785746
N-(2-bromo-4-sulfamoylphenyl)-5-fluoropyridine-3-carboxamide
CID 104786050
N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide
CID 43246544
5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 115694821
N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-4-carboxamide
CID 63080493
5-fluoro-N-(2-sulfamoylphenyl)pyridine-3-carboxamide
CID 104786397
3-fluoro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 4155198
N-(4-chloro-2-methylphenyl)-4-sulfamoylbenzamide
CID 26698295
N-(2-methyl-4-sulfamoylphenyl)-1H-pyrazole-5-carboxamide
CID 63080492
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
3-fluoro-4-[(5-fluoropyridine-3-carbonyl)amino]benzoic acid
CID 115867825
N-(2-chloro-4-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
CID 43134081

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide (CID 104786047) is 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide is Cc1cc(S(N)(=O)=O)ccc1NC(=O)c1cncc(F)c1.
What is the InChIKey of 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide?
The InChIKey is KZORMDFGYXYYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O3S/c1-8-4-11(21(15,19)20)2-3-12(8)17-13(18)9-5-10(14)7-16-6-9/h2-7H,1H3,(H,17,18)(H2,15,19,20).
What are the key properties of 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide?
5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide has a molecular weight of 309.32 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(2-methyl-4-sulfamoylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 104786047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).