1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone

C11H10N2O2 — CID 139984625

IUPAC1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone
SMILESCC(=O)c1cc(-c2ncco2)ncc1C
InChIInChI=1S/C11H10N2O2/c1-7-6-13-10(5-9(7)8(2)14)11-12-3-4-15-11/h3-6H,1-2H3
InChIKeyWKBAVPKQZNRKRI-UHFFFAOYSA-N
MW202.21 g/mol
LogP2.25
Rot. Bonds2

About 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone

1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone (PubChem CID 139984625) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone.

Molecular Properties

Compound Name1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone
PubChem CID139984625
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone
SMILESCC(=O)c1cc(-c2ncco2)ncc1C
InChIInChI=1S/C11H10N2O2/c1-7-6-13-10(5-9(7)8(2)14)11-12-3-4-15-11/h3-6H,1-2H3
InChIKeyWKBAVPKQZNRKRI-UHFFFAOYSA-N
XLogP2.25
TPSA55.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-5-(1,3-oxazol-2-yl)benzoic acid
CID 170993673
3-methyl-2-(1,3-oxazol-2-yl)benzoic acid
CID 90411827
3-methyl-5-(1,3-oxazol-2-yl)benzamide
CID 142673231
3,5-dimethyl-4-(1,3-oxazol-2-yl)benzenesulfonic acid
CID 175447447
N-methoxy-4-(1,3-oxazol-2-yl)pyrimidin-2-amine
CID 162786254
5-methyl-2-pyridin-3-ylpyridine-4-carbonyl chloride
CID 163503116
2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide
CID 87428377
dimethyl 5-(1,3-oxazol-2-yl)benzene-1,3-dicarboxylate
CID 11379968
5-methyl-2-(1,3-oxazol-2-yl)pyridin-3-amine
CID 150227400
2-(2,4-dichlorophenyl)-5-methylpyridine-4-carboxylic acid
CID 118824898
5-methylpyridine-2,4-dicarboxylic acid;hydrochloride
CID 156874397
N-[8-amino-7-fluoro-6-[4-methyl-6-(1,3-oxazol-2-yl)-3-pyridinyl]isoquinolin-3-yl]cyclopropanecarboxamide
CID 142447902

Frequently Asked Questions

What is the IUPAC name of 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone?
The IUPAC name of 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone (CID 139984625) is 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone.
What is the SMILES notation for 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone?
The canonical SMILES for 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone is CC(=O)c1cc(-c2ncco2)ncc1C.
What is the InChIKey of 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone?
The InChIKey is WKBAVPKQZNRKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-6-13-10(5-9(7)8(2)14)11-12-3-4-15-11/h3-6H,1-2H3.
What are the key properties of 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone?
1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone has a molecular weight of 202.21 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-methyl-2-(1,3-oxazol-2-yl)-4-pyridinyl]ethanone is sourced from PubChem (CID 139984625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).