2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid

C14H14N2O4S — CID 79042866

IUPAC2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid
SMILESCc1ccc(S(=O)(=O)Nc2cccnc2C)cc1C(=O)O
InChIInChI=1S/C14H14N2O4S/c1-9-5-6-11(8-12(9)14(17)18)21(19,20)16-13-4-3-7-15-10(13)2/h3-8,16H,1-2H3,(H,17,18)
InChIKeySTQPYOGQYDSJRT-UHFFFAOYSA-N
MW306.34 g/mol
LogP2.20
Rot. Bonds4

About 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid

2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid (PubChem CID 79042866) has the molecular formula C14H14N2O4S and a molecular weight of 306.34 g/mol. Its IUPAC name is 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid.

Molecular Properties

Compound Name2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid
PubChem CID79042866
Molecular FormulaC14H14N2O4S
Molecular Weight306.34 g/mol
Exact Mass306.07
IUPAC Name2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid
SMILESCc1ccc(S(=O)(=O)Nc2cccnc2C)cc1C(=O)O
InChIInChI=1S/C14H14N2O4S/c1-9-5-6-11(8-12(9)14(17)18)21(19,20)16-13-4-3-7-15-10(13)2/h3-8,16H,1-2H3,(H,17,18)
InChIKeySTQPYOGQYDSJRT-UHFFFAOYSA-N
XLogP2.20
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid 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

2-iodo-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid
CID 103962591
5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]-2-methylbenzoic acid
CID 65486231
3-amino-4-hydroxy-N-(2-methyl-3-pyridinyl)benzenesulfonamide
CID 79042553
5-[(2-chloro-3-pyridinyl)sulfamoyl]-2-fluorobenzoic acid
CID 43237867
3-[(3,4-dimethylphenyl)sulfonylamino]-2-methylbenzoic acid
CID 60603862
2-chloro-4-[(2-chloro-3-pyridinyl)sulfamoyl]benzoic acid
CID 103710289
5-[(3-carboxyphenyl)sulfamoyl]-2-methylbenzoic acid
CID 45407611
3-[(4-methylphenyl)sulfonylamino]pyridine-2-carboxylic acid
CID 115778031
2-methyl-5-[[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]sulfamoyl]benzamide
CID 60532014
N-cycloheptyl-2-methyl-5-[(2-methylphenyl)sulfamoyl]benzamide
CID 25342365
5-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]sulfamoyl]-2-methylbenzoic acid
CID 107848139
2-methyl-5-(phenylsulfamoyl)benzamide
CID 870864

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid?
The IUPAC name of 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid (CID 79042866) is 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid.
What is the SMILES notation for 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid?
The canonical SMILES for 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid is Cc1ccc(S(=O)(=O)Nc2cccnc2C)cc1C(=O)O.
What is the InChIKey of 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid?
The InChIKey is STQPYOGQYDSJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4S/c1-9-5-6-11(8-12(9)14(17)18)21(19,20)16-13-4-3-7-15-10(13)2/h3-8,16H,1-2H3,(H,17,18).
What are the key properties of 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid?
2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid has a molecular weight of 306.34 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(2-methyl-3-pyridinyl)sulfamoyl]benzoic acid is sourced from PubChem (CID 79042866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).