Benzenemethanesulfonamide, 4-amino-N-methyl-, hydrochloride (1:1)

C₈H₁₃ClN₂O₂SCAS 88918-84-7236.71 g/mol

Open in Covalent MOL file

Primary amine Sulfonamide

Properties

Molecular formula: C₈H₁₃ClN₂O₂S
Molar mass: 236.71 g/mol
Exact mass: 236.0386 Da
logP: 0.74Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Identifiers

CAS number

88918-84-7

SMILES

CNS(=O)(=O)Cc1ccc(N)cc1.Cl

InChIKey

VKLYKCNYIYHJEY-UHFFFAOYSA-N

InChI

InChI=1S/C8H12N2O2S.ClH/c1-10-13(11,12)6-7-2-4-8(9)5-3-7;/h2-5,10H,6,9H2,1H3;1H

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Names and synonyms

1 names

Benzenemethanesulfonamide, 4-amino-N-methyl-, monohydrochloride

Work with Benzenemethanesulfonamide, 4-amino-N-methyl-, hydrochloride (1:1)

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

4-Amino-N-methylbenzenemethanesulfonamide109903-35-790 % similar 4-Hydrazino-N-methylbenzenemethanesulfonamide hydrochloride88933-16-869 % similar N-Methyl-4-nitrobenzenemethanesulfonamide85952-29-051 % similar 3-(2-Aminoethyl)-N-methyl-1H-indole-5-methanesulfonamide88919-22-642 % similar 4-Amino-N-methylbenzenemethanamine38020-69-842 % similar N-Methyl-p-phenylenediamine dihydrochloride5395-70-042 % similar 4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine334981-10-141 % similar Benzenamine, 4-(phenylmethyl)-, hydrochloride (1:1)6317-57-341 % similar

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

Elsewhere

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