5-Amino-2-methyl-N-phenylbenzenesulfonamide

C₁₃H₁₄N₂O₂SCAS 79-72-1262.33 g/mol

Open in Covalent MOL file

Primary amine Sulfonamide

Properties

Molecular formula: C₁₃H₁₄N₂O₂S
Molar mass: 262.33 g/mol
Exact mass: 262.0776 Da
Melting point: 145 °C
logP: 2.38Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Identifiers

CAS number

79-72-1

SMILES

Cc1ccc(N)cc1S(=O)(=O)Nc1ccccc1

InChIKey

HCAKHJQTCPZXPR-UHFFFAOYSA-N

InChI

InChI=1S/C13H14N2O2S/c1-10-7-8-11(14)9-13(10)18(16,17)15-12-5-3-2-4-6-12/h2-9,15H,14H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names

Benzenesulfonamide, 5-amino-2-methyl-N-phenyl-
o-Toluenesulfonanilide, 5-amino-
5-Amino-o-toluenesulfonanilide
5-Amino-2-toluenesulfonanilide
NSC 37094

Work with 5-Amino-2-methyl-N-phenylbenzenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Amino-N-phenylbenzenesulfonamide80-21-756 % similar 5-Amino-2-methylbenzenesulfonamide6973-09-753 % similar 5-Amino-2-methylbenzenesulfonic acid118-88-751 % similar 5-Amino-N-ethyl-2-methyl-N-phenylbenzenesulfonamide51123-09-249 % similar 4-Amino-2,5-dimethoxy-N-phenylbenzenesulfonamide52298-44-949 % similar 5-Amino-2-chloro-N-(2,4-dimethylphenyl)benzenesulfonamide71215-81-147 % similar 4,4′-Diaminobenzenesulfonanilide16803-97-746 % similar N-Phenylbenzenesulfonamide1678-25-745 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook