chempirical

3-Acetyl-2-methyl-1,6-naphthyridine

C11H10N2OCAS 52816-65-6186.21 g/mol

Open in Covalent MOL file
NNO
Ketone

Properties

Molecular formula
C11H10N2O
Molar mass
186.21 g/mol
Exact mass
186.0793 Da
logP
2.14Crippen estimate
Polar surface area
42.9 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
52816-65-6
SMILES
CC1=C(C=C2C=NC=CC2=N1)C(=O)C
InChIKey
IKNXDFVOTFRCCA-UHFFFAOYSA-N
InChI
InChI=1S/C11H10N2O/c1-7-10(8(2)14)5-9-6-12-4-3-11(9)13-7/h3-6H,1-2H3

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Work with 3-Acetyl-2-methyl-1,6-naphthyridine

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

1-(3-Bromopyridin-4-yl)ethanone111043-06-245 % similar 2-(Trifluoromethyl)-1,6-naphthyridine-3-carboxylic acid240408-97-344 % similar 1-(2-Amino-4-methylpyrimidin-5-yl)ethan-1-one66373-25-943 % similar 1,6-Naphthyridine-2-carboxylic acid197507-59-839 % similar 4-Acetylpyridine1122-54-938 % similar 3-Acetylpyridine350-03-838 % similar 9-Acetylphenanthrene2039-77-236 % similar Acetylpyrazine22047-25-236 % similar

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

Same formula

1-[4-(1H-Imidazol-1-yl)phenyl]ethanone10041-06-2 6-Methoxy-1H-indole-3-acetonitrile23084-35-7 2-(5-Methoxy-1H-indol-3-yl)acetonitrile2436-17-1 6'-Methoxy-2,3'-bipyridyl381725-49-1 2-Naphthoic acid hydrazide39627-84-4 1-Naphthoic hydrazide43038-45-5 1-Benzyl-1H-pyrazole-4-carbaldehyde63874-95-3 1-Benzyl-1H-imidazole-5-carboxaldehyde85102-99-4

Elsewhere

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