3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole

C8H4F3NOS — CID 736194

IUPAC3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole
SMILESFC(F)(F)c1cc(-c2cccs2)no1
InChIInChI=1S/C8H4F3NOS/c9-8(10,11)7-4-5(12-13-7)6-2-1-3-14-6/h1-4H
InChIKeyTUQUPXBKYCKHTB-UHFFFAOYSA-N
MW219.19 g/mol
LogP3.42
Rot. Bonds1

About 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole

3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole (PubChem CID 736194) has the molecular formula C8H4F3NOS and a molecular weight of 219.19 g/mol. Its IUPAC name is 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole.

Molecular Properties

Compound Name3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole
PubChem CID736194
Molecular FormulaC8H4F3NOS
Molecular Weight219.19 g/mol
Exact Mass219.00
IUPAC Name3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole
SMILESFC(F)(F)c1cc(-c2cccs2)no1
InChIInChI=1S/C8H4F3NOS/c9-8(10,11)7-4-5(12-13-7)6-2-1-3-14-6/h1-4H
InChIKeyTUQUPXBKYCKHTB-UHFFFAOYSA-N
XLogP3.42
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.19
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole?
The IUPAC name of 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole (CID 736194) is 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole.
What is the SMILES notation for 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole?
The canonical SMILES for 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole is FC(F)(F)c1cc(-c2cccs2)no1.
What is the InChIKey of 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole?
The InChIKey is TUQUPXBKYCKHTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F3NOS/c9-8(10,11)7-4-5(12-13-7)6-2-1-3-14-6/h1-4H.
What are the key properties of 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole?
3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole has a molecular weight of 219.19 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole is sourced from PubChem (CID 736194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).