1-(2-Quinoxalinyl)ethanone

C₁₀H₈N₂OCAS 25594-62-1172.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₈N₂O
Molar mass: 172.19 g/mol
Exact mass: 172.0637 Da
Melting point: 77 °C
logP: 1.83Crippen estimate
Polar surface area: 42.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

25594-62-1

SMILES

CC(=O)c1cnc2ccccc2n1

InChIKey

SWGILLQQUULMJB-UHFFFAOYSA-N

InChI

InChI=1S/C10H8N2O/c1-7(13)10-6-11-8-4-2-3-5-9(8)12-10/h2-6H,1H3

Weigh it out

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

Names and synonyms

4 names

Ethanone, 1-(2-quinoxalinyl)-
Ketone, methyl 2-quinoxalinyl
2-Acetylquinoxaline
1-(Quinoxalin-2-yl)ethan-1-one

Work with 1-(2-Quinoxalinyl)ethanone

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

2,6-Diacetylpyridine1129-30-252 % similar 2-Acetylpyridine1122-62-952 % similar 2-Methylquinoxaline7251-61-845 % similar 1-(6-Methyl-2-pyridinyl)ethanone6940-57-444 % similar Acetylpyrazine22047-25-243 % similar 1,2-Diacetylbenzene704-00-742 % similar 1-(Pyridazin-3-yl)ethan-1-one1122-63-042 % similar 2-Chloroquinoxaline1448-87-941 % similar

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

Same formula

4-(1H-Imidazol-1-yl)benzaldehyde10040-98-9 1H-Imidazol-1-ylphenylmethanone10364-94-0 2-(1H-Pyrazol-1-yl)benzaldehyde138479-47-7 6-Phenyl-3(2H)-pyridazinone2166-31-6 4-Dicyanomethylene-2,6-dimethyl-4H-pyran28286-88-6

Elsewhere

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