N-(3-Amino-4-chlorophenyl)acetamide

C₈H₉ClN₂OCAS 51867-83-5184.62 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₈H₉ClN₂O
Molar mass: 184.62 g/mol
Exact mass: 184.0403 Da
Melting point: 170 °C
logP: 2.53Crippen estimate
Polar surface area: 58.6 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

51867-83-5

SMILES

CC(O)=Nc1ccc(Cl)c(N)c1

InChIKey

MIIPQGGYCFVDAI-UHFFFAOYSA-N

InChI

InChI=1S/C8H9ClN2O/c1-5(12)11-6-2-3-7(9)8(10)4-6/h2-4H,10H2,1H3,(H,11,12)

Weigh it out

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

Names and synonyms

3 names

Acetamide, N-(3-amino-4-chlorophenyl)-
5-Acetamido-2-chloroaniline
1-Amino-3-acetylamino-6-chloro-benzene

Work with N-(3-Amino-4-chlorophenyl)acetamide

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

N-(3-Amino-4-methoxyphenyl)acetamide6375-47-961 % similar 5-Acetamidoanthranilic acid50670-83-257 % similar 4-Acetamido-2-aminobenzenesulfonic acid88-64-255 % similar 3-Aminoacetanilide102-28-354 % similar N-[4-Amino-3-(trifluoromethyl)phenyl]acetamide1579-89-154 % similar N-(4-Chloro-3-nitrophenyl)acetamide5540-60-353 % similar N,N′-Diacetyl-P-phenylenediamine140-50-152 % similar 4-Aminoacetanilide122-80-551 % similar

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

Elsewhere

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