3-cyclohexyl-5-cyclopropyl-1,2-oxazole

C12H17NO — CID 154245938

IUPAC3-cyclohexyl-5-cyclopropyl-1,2-oxazole
SMILESc1c(C2CCCCC2)noc1C1CC1
InChIInChI=1S/C12H17NO/c1-2-4-9(5-3-1)11-8-12(14-13-11)10-6-7-10/h8-10H,1-7H2
InChIKeyQLKMRTFXEVZPGZ-UHFFFAOYSA-N
MW191.27 g/mol
LogP3.60
Rot. Bonds2

About 3-cyclohexyl-5-cyclopropyl-1,2-oxazole

3-cyclohexyl-5-cyclopropyl-1,2-oxazole (PubChem CID 154245938) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-cyclohexyl-5-cyclopropyl-1,2-oxazole.

Molecular Properties

Compound Name3-cyclohexyl-5-cyclopropyl-1,2-oxazole
PubChem CID154245938
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-cyclohexyl-5-cyclopropyl-1,2-oxazole
SMILESc1c(C2CCCCC2)noc1C1CC1
InChIInChI=1S/C12H17NO/c1-2-4-9(5-3-1)11-8-12(14-13-11)10-6-7-10/h8-10H,1-7H2
InChIKeyQLKMRTFXEVZPGZ-UHFFFAOYSA-N
XLogP3.60
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-3-cyclopentyl-1,2-oxazole
CID 80645479
5-cyclohexyl-1,2-oxazole-3-carbaldehyde
CID 82409658
1-(5-cyclohexyl-1,2-oxazol-3-yl)ethanone
CID 115094361
cyclodecyl-[(2S)-2-(5-cyclodecyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 139317400
3-cyclopentyl-1,2-oxazole-5-carboxylic acid
CID 56828658
2-(3-cyclopentyl-1,2-oxazol-5-yl)ethanamine
CID 82408902
methyl 5-cyclohexyl-1,2-oxazole-3-carboxylate
CID 154791565
3-cyclopentyl-1,2-oxazole-5-sulfonamide
CID 167728142
2-(3-cyclobutyl-1,2-oxazol-5-yl)propan-2-amine
CID 83846539
bis(5-cyclopropyl-1,2-oxazol-3-yl)methanone
CID 175316695
1-(3-cycloheptyl-1,2-oxazol-5-yl)butan-1-amine
CID 114160497
2-(3-cyclobutyl-1,2-oxazol-5-yl)ethanamine
CID 83845883

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-5-cyclopropyl-1,2-oxazole?
The IUPAC name of 3-cyclohexyl-5-cyclopropyl-1,2-oxazole (CID 154245938) is 3-cyclohexyl-5-cyclopropyl-1,2-oxazole.
What is the SMILES notation for 3-cyclohexyl-5-cyclopropyl-1,2-oxazole?
The canonical SMILES for 3-cyclohexyl-5-cyclopropyl-1,2-oxazole is c1c(C2CCCCC2)noc1C1CC1.
What is the InChIKey of 3-cyclohexyl-5-cyclopropyl-1,2-oxazole?
The InChIKey is QLKMRTFXEVZPGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-2-4-9(5-3-1)11-8-12(14-13-11)10-6-7-10/h8-10H,1-7H2.
What are the key properties of 3-cyclohexyl-5-cyclopropyl-1,2-oxazole?
3-cyclohexyl-5-cyclopropyl-1,2-oxazole has a molecular weight of 191.27 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-5-cyclopropyl-1,2-oxazole is sourced from PubChem (CID 154245938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).