5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one

C12H12F3NO3 — CID 150594784

IUPAC5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one
SMILESO=C1OC(CCO)C(C(F)(F)F)N1c1ccccc1
InChIInChI=1S/C12H12F3NO3/c13-12(14,15)10-9(6-7-17)19-11(18)16(10)8-4-2-1-3-5-8/h1-5,9-10,17H,6-7H2
InChIKeyIQPSOXGEKJVINN-UHFFFAOYSA-N
MW275.23 g/mol
LogP2.33
Rot. Bonds3

About 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one

5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one (PubChem CID 150594784) has the molecular formula C12H12F3NO3 and a molecular weight of 275.23 g/mol. Its IUPAC name is 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one
PubChem CID150594784
Molecular FormulaC12H12F3NO3
Molecular Weight275.23 g/mol
Exact Mass275.08
IUPAC Name5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one
SMILESO=C1OC(CCO)C(C(F)(F)F)N1c1ccccc1
InChIInChI=1S/C12H12F3NO3/c13-12(14,15)10-9(6-7-17)19-11(18)16(10)8-4-2-1-3-5-8/h1-5,9-10,17H,6-7H2
InChIKeyIQPSOXGEKJVINN-UHFFFAOYSA-N
XLogP2.33
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.23
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one 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 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one (CID 150594784) is 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one is O=C1OC(CCO)C(C(F)(F)F)N1c1ccccc1.
What is the InChIKey of 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
The InChIKey is IQPSOXGEKJVINN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F3NO3/c13-12(14,15)10-9(6-7-17)19-11(18)16(10)8-4-2-1-3-5-8/h1-5,9-10,17H,6-7H2.
What are the key properties of 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one has a molecular weight of 275.23 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxyethyl)-3-phenyl-4-(trifluoromethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 150594784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).