2-Amino-5-chloro-N,3-dimethylbenzamide

C₉H₁₁ClN₂OCAS 890707-28-5198.65 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₉H₁₁ClN₂O
Molar mass: 198.65 g/mol
Exact mass: 198.0560 Da
Melting point: 130–132 °C
logP: 2.17Crippen estimate
Polar surface area: 58.6 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

890707-28-5

SMILES

CN=C(O)c1cc(Cl)cc(C)c1N

InChIKey

WOBVZGBINMTNKL-UHFFFAOYSA-N

InChI

InChI=1S/C9H11ClN2O/c1-5-3-6(10)4-7(8(5)11)9(13)12-2/h3-4H,11H2,1-2H3,(H,12,13)

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Names and synonyms

2 names

Benzamide, 2-amino-5-chloro-N,3-dimethyl-
2-Amino-5-chloro-N-methyl-3-methylbenzamide

Work with 2-Amino-5-chloro-N,3-dimethylbenzamide

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

2-Amino-5-chloro-3-methylbenzoic acid20776-67-460 % similar 3,5-Dichloroanthranilic acid2789-92-638 % similar 4-Chloro-2,6-dimethylphenol1123-63-337 % similar 2-Amino-3-methylbenzoic acid4389-45-136 % similar 5-Chloro-2-methylbenzoic acid7499-06-136 % similar 4-Chloro-2-methylbenzoic acid7499-07-236 % similar 4-Chloro-O-toluidine95-69-235 % similar Chloramben133-90-435 % similar

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

Same formula

3-(4-Chlorophenyl)-1,1-dimethylurea150-68-5

Elsewhere

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