2-Acetyl-3,5-dimethylpyrazine

C₈H₁₀N₂OCAS 54300-08-2150.18 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₁₀N₂O
Molar mass: 150.18 g/mol
Exact mass: 150.0793 Da
Boiling point: 70 °C (at 7 Torr)
logP: 1.30Crippen estimate
Polar surface area: 42.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

54300-08-2

SMILES

CC(=O)c1ncc(C)nc1C

InChIKey

UCGOSAWBWFUKDT-UHFFFAOYSA-N

InChI

InChI=1S/C8H10N2O/c1-5-4-9-8(7(3)11)6(2)10-5/h4H,1-3H3

Weigh it out

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

Names and synonyms

4 names

Ethanone, 1-(3,5-dimethyl-2-pyrazinyl)-
Ethanone, 1-(3,5-dimethylpyrazinyl)-
1-(3,5-Dimethyl-2-pyrazinyl)ethanone
1-(3,5-Dimethylpyrazin-2-yl)ethan-1-one

Work with 2-Acetyl-3,5-dimethylpyrazine

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-Acetyl-3-methylpyrazine23787-80-656 % similar 2,3,5-Trimethylpyrazine14667-55-150 % similar 1-(6-Methyl-3-pyridinyl)ethanone36357-38-744 % similar 2-Chloro-3,5-dimethylpyrazine38557-72-144 % similar 2-Ethyl-3,5-dimethylpyrazine13925-07-042 % similar 1-(6-Methyl-2-pyridinyl)ethanone6940-57-441 % similar 3,6-Dimethylpyrazin-2-amine13134-38-840 % similar 3-Chloro-2,5-dimethylpyrazine95-89-640 % similar

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

Same formula

3-Aminoacetanilide102-28-3 Acetylphenylhydrazine114-83-0 4-Aminoacetanilide122-80-5 3-Methylbenzohydrazide13050-47-0 N,N-Dimethyl-4-nitrosoaniline138-89-6 4-Methylbenzamidoxime19227-13-5 3-Amino-4-methylbenzamide19406-86-1 2-Acetyl-3-ethylpyrazine32974-92-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook