2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine

C7H7F3N2OS — CID 75504409

IUPAC2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine
SMILESFC(F)(F)c1csc(N2CCCO2)n1
InChIInChI=1S/C7H7F3N2OS/c8-7(9,10)5-4-14-6(11-5)12-2-1-3-13-12/h4H,1-3H2
InChIKeyCCYULYDKZQVYAA-UHFFFAOYSA-N
MW224.21 g/mol
LogP2.30
Rot. Bonds1

About 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine

2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine (PubChem CID 75504409) has the molecular formula C7H7F3N2OS and a molecular weight of 224.21 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine
PubChem CID75504409
Molecular FormulaC7H7F3N2OS
Molecular Weight224.21 g/mol
Exact Mass224.02
IUPAC Name2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine
SMILESFC(F)(F)c1csc(N2CCCO2)n1
InChIInChI=1S/C7H7F3N2OS/c8-7(9,10)5-4-14-6(11-5)12-2-1-3-13-12/h4H,1-3H2
InChIKeyCCYULYDKZQVYAA-UHFFFAOYSA-N
XLogP2.30
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.21
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine?
The IUPAC name of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine (CID 75504409) is 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine.
What is the SMILES notation for 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine?
The canonical SMILES for 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine is FC(F)(F)c1csc(N2CCCO2)n1.
What is the InChIKey of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine?
The InChIKey is CCYULYDKZQVYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2OS/c8-7(9,10)5-4-14-6(11-5)12-2-1-3-13-12/h4H,1-3H2.
What are the key properties of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine?
2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine has a molecular weight of 224.21 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,2-oxazolidine is sourced from PubChem (CID 75504409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).