chempirical

5-Amino-2-methylbenzenesulfonamide

C7H10N2O2SCAS 6973-09-7186.23 g/mol

Open in Covalent MOL file
NH2SH2NOO
Primary amineSulfonamide

Properties

Molecular formula
C7H10N2O2S
Molar mass
186.23 g/mol
Exact mass
186.0463 Da
logP
0.22Crippen estimate
Polar surface area
86.2 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
6973-09-7
SMILES
Cc1ccc(N)cc1S(N)(=O)=O
InChIKey
KTPBKMYOIFHJMI-UHFFFAOYSA-N
InChI
InChI=1S/C7H10N2O2S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,8H2,1H3,(H2,9,10,11)

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

Names and synonyms

5 names
  • Benzenesulfonamide, 5-amino-2-methyl-
  • 3-Amino-6-methylbenzenesulfonamide
  • NSC 36969
  • 3-Aminosulfonyl-4-methylaniline
  • 2-Methyl-5-amino-benzenesulfonamide

Work with 5-Amino-2-methylbenzenesulfonamide

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

5-Amino-2-methylbenzenesulfonic acid118-88-762 % similar 2-Methylbenzenesulfonamide88-19-756 % similar 5-Amino-2-methyl-N-phenylbenzenesulfonamide79-72-153 % similar 3,4-Xylidine95-64-750 % similar Sulfanilamide63-74-147 % similar 2,4-Diaminotoluene95-80-747 % similar 5-Amino-N-ethyl-2-methyl-N-phenylbenzenesulfonamide51123-09-247 % similar Toluenesulfonamide1333-07-946 % similar

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

Same formula

2-[1-(Ethylsulfonyl)-3-azetidinylidene]acetonitrile1187595-85-2 Tosylhydrazine1576-35-8 Carbimazole22232-54-8 4,6-Dimethyl-2-(methylsulfonyl)pyrimidine35144-22-0 Ethyl 2-amino-4-thiazoleacetate53266-94-7 4-Amino-3-methylbenzenesulfonamide53297-70-4 3-Amino-4-methylbenzenesulfonamide6274-28-8 P-(Methylsulfonyl)phenylhydrazine877-66-7

Elsewhere

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