5-ethyl-2-(trifluoromethyl)-1,3-oxazole

C6H6F3NO — CID 167491027

IUPAC5-ethyl-2-(trifluoromethyl)-1,3-oxazole
SMILESCCc1cnc(C(F)(F)F)o1
InChIInChI=1S/C6H6F3NO/c1-2-4-3-10-5(11-4)6(7,8)9/h3H,2H2,1H3
InChIKeyWXYZAZIMSHJHHM-UHFFFAOYSA-N
MW165.11 g/mol
LogP2.26
Rot. Bonds1

About 5-ethyl-2-(trifluoromethyl)-1,3-oxazole

5-ethyl-2-(trifluoromethyl)-1,3-oxazole (PubChem CID 167491027) has the molecular formula C6H6F3NO and a molecular weight of 165.11 g/mol. Its IUPAC name is 5-ethyl-2-(trifluoromethyl)-1,3-oxazole.

Molecular Properties

Compound Name5-ethyl-2-(trifluoromethyl)-1,3-oxazole
PubChem CID167491027
Molecular FormulaC6H6F3NO
Molecular Weight165.11 g/mol
Exact Mass165.04
IUPAC Name5-ethyl-2-(trifluoromethyl)-1,3-oxazole
SMILESCCc1cnc(C(F)(F)F)o1
InChIInChI=1S/C6H6F3NO/c1-2-4-3-10-5(11-4)6(7,8)9/h3H,2H2,1H3
InChIKeyWXYZAZIMSHJHHM-UHFFFAOYSA-N
XLogP2.26
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.11
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-ethyl-2-(trifluoromethyl)-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-Dimethyloxazole
CID 89961
5-Ethyl-2-methyloxazole
CID 528407
2-Ethyl-5-methyloxazole
CID 528403
5-Methyl-2-propyloxazole
CID 529034
5-(1-Methylethyl)oxazole
CID 12214112
5-Ethyl-1,3-oxazole
CID 12214113
2-Methyl-5-propyloxazole
CID 529029
2,2,2-Trifluoro-1-(5-methyl-1,3-oxazol-2-yl)ethan-1-one
CID 137965662
2-(2-Methyl-1,3-oxazol-5-yl)acetonitrile
CID 44119609
[5-(Propan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 54594018
2-(Chloromethyl)-5-ethyl-1,3-oxazole
CID 54595701
(5-Ethyl-1,3-oxazol-2-yl)methanamine
CID 65180193

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(trifluoromethyl)-1,3-oxazole?
The IUPAC name of 5-ethyl-2-(trifluoromethyl)-1,3-oxazole (CID 167491027) is 5-ethyl-2-(trifluoromethyl)-1,3-oxazole.
What is the SMILES notation for 5-ethyl-2-(trifluoromethyl)-1,3-oxazole?
The canonical SMILES for 5-ethyl-2-(trifluoromethyl)-1,3-oxazole is CCc1cnc(C(F)(F)F)o1.
What is the InChIKey of 5-ethyl-2-(trifluoromethyl)-1,3-oxazole?
The InChIKey is WXYZAZIMSHJHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F3NO/c1-2-4-3-10-5(11-4)6(7,8)9/h3H,2H2,1H3.
What are the key properties of 5-ethyl-2-(trifluoromethyl)-1,3-oxazole?
5-ethyl-2-(trifluoromethyl)-1,3-oxazole has a molecular weight of 165.11 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(trifluoromethyl)-1,3-oxazole is sourced from PubChem (CID 167491027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).