3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one

C17H16FNO2 — CID 21219527

IUPAC3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one
SMILESCC(c1ccccc1)N1C(=O)C(c2ccc(F)cc2)C1O
InChIInChI=1S/C17H16FNO2/c1-11(12-5-3-2-4-6-12)19-16(20)15(17(19)21)13-7-9-14(18)10-8-13/h2-11,15-16,20H,1H3
InChIKeyXGCGWJXPMYCOFL-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.83
Rot. Bonds3

About 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one

3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one (PubChem CID 21219527) has the molecular formula C17H16FNO2 and a molecular weight of 285.32 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one.

Molecular Properties

Compound Name3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one
PubChem CID21219527
Molecular FormulaC17H16FNO2
Molecular Weight285.32 g/mol
Exact Mass285.12
IUPAC Name3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one
SMILESCC(c1ccccc1)N1C(=O)C(c2ccc(F)cc2)C1O
InChIInChI=1S/C17H16FNO2/c1-11(12-5-3-2-4-6-12)19-16(20)15(17(19)21)13-7-9-14(18)10-8-13/h2-11,15-16,20H,1H3
InChIKeyXGCGWJXPMYCOFL-UHFFFAOYSA-N
XLogP2.83
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-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 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one?
The IUPAC name of 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one (CID 21219527) is 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one.
What is the SMILES notation for 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one?
The canonical SMILES for 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one is CC(c1ccccc1)N1C(=O)C(c2ccc(F)cc2)C1O.
What is the InChIKey of 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one?
The InChIKey is XGCGWJXPMYCOFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO2/c1-11(12-5-3-2-4-6-12)19-16(20)15(17(19)21)13-7-9-14(18)10-8-13/h2-11,15-16,20H,1H3.
What are the key properties of 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one?
3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one has a molecular weight of 285.32 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-4-hydroxy-1-(1-phenylethyl)azetidin-2-one is sourced from PubChem (CID 21219527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).