1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone

C11H15NO2 — CID 115094361

IUPAC1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone
SMILESCC(=O)c1cc(C2CCCCC2)on1
InChIInChI=1S/C11H15NO2/c1-8(13)10-7-11(14-12-10)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3
InChIKeyQBSZGBFREURQRE-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.92
Rot. Bonds2

About 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone

1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone (PubChem CID 115094361) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone.

Molecular Properties

Compound Name1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone
PubChem CID115094361
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone
SMILESCC(=O)c1cc(C2CCCCC2)on1
InChIInChI=1S/C11H15NO2/c1-8(13)10-7-11(14-12-10)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3
InChIKeyQBSZGBFREURQRE-UHFFFAOYSA-N
XLogP2.92
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-cyclopropyl-1,2-oxazol-3-yl)ethanone;ethane
CID 178176268
methyl 5-cyclohexyl-1,2-oxazole-3-carboxylate
CID 154791565
bis(5-cyclopropyl-1,2-oxazol-3-yl)methanone
CID 175316695
3-cyclohexyl-5-cyclopropyl-1,2-oxazole
CID 154245938
(5-cyclopropyl-1,2-oxazol-3-yl)-(2-methylpiperidin-1-yl)methanone
CID 22427517
9-azabicyclo[6.2.0]decan-9-yl-(5-cyclopropyl-1,2-oxazol-3-yl)methanone
CID 119042459
5-cyclohexyl-1,2-oxazole-3-carbaldehyde
CID 82409658
(5-cyclopropyl-1,2-oxazol-3-yl)-(2,6-dimethylpiperidin-1-yl)methanone
CID 22427513
(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate
CID 118728308
2-[cyclopentyl-(5-cyclopropyl-1,2-oxazole-3-carbonyl)amino]acetic acid
CID 60826942
N-cyclohexyl-5-cyclopropyl-N-(4-propylcyclohexyl)-1,2-oxazole-3-carboxamide
CID 56973396
5-cyclopropyl-N-methylsulfonyl-1,2-oxazole-3-carboxamide
CID 154774184

Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone?
The IUPAC name of 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone (CID 115094361) is 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone.
What is the SMILES notation for 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone?
The canonical SMILES for 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone is CC(=O)c1cc(C2CCCCC2)on1.
What is the InChIKey of 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone?
The InChIKey is QBSZGBFREURQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8(13)10-7-11(14-12-10)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3.
What are the key properties of 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone?
1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone has a molecular weight of 193.25 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone is sourced from PubChem (CID 115094361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).