4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one

C10H7ClF3NO2 — CID 89496923

IUPAC4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one
SMILESO=C1NC(c2cccc(Cl)c2)(C(F)(F)F)CO1
InChIInChI=1S/C10H7ClF3NO2/c11-7-3-1-2-6(4-7)9(10(12,13)14)5-17-8(16)15-9/h1-4H,5H2,(H,15,16)
InChIKeyRAOKIXLGMGZUGN-UHFFFAOYSA-N
MW265.62 g/mol
LogP2.84
Rot. Bonds1

About 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one

4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one (PubChem CID 89496923) has the molecular formula C10H7ClF3NO2 and a molecular weight of 265.62 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one
PubChem CID89496923
Molecular FormulaC10H7ClF3NO2
Molecular Weight265.62 g/mol
Exact Mass265.01
IUPAC Name4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one
SMILESO=C1NC(c2cccc(Cl)c2)(C(F)(F)F)CO1
InChIInChI=1S/C10H7ClF3NO2/c11-7-3-1-2-6(4-7)9(10(12,13)14)5-17-8(16)15-9/h1-4H,5H2,(H,15,16)
InChIKeyRAOKIXLGMGZUGN-UHFFFAOYSA-N
XLogP2.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.62
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(3-chlorophenyl)-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 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
The IUPAC name of 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one (CID 89496923) is 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one is O=C1NC(c2cccc(Cl)c2)(C(F)(F)F)CO1.
What is the InChIKey of 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
The InChIKey is RAOKIXLGMGZUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClF3NO2/c11-7-3-1-2-6(4-7)9(10(12,13)14)5-17-8(16)15-9/h1-4H,5H2,(H,15,16).
What are the key properties of 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one?
4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one has a molecular weight of 265.62 g/mol, XLogP of 2.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-4-(trifluoromethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 89496923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).