5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole

C15H12FNO — CID 91326028

IUPAC5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole
SMILESFc1ccc(C2(c3ccccc3)CC=NO2)cc1
InChIInChI=1S/C15H12FNO/c16-14-8-6-13(7-9-14)15(10-11-17-18-15)12-4-2-1-3-5-12/h1-9,11H,10H2
InChIKeyULKOQNVFHBGETA-UHFFFAOYSA-N
MW241.27 g/mol
LogP3.48
Rot. Bonds2

About 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole

5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole (PubChem CID 91326028) has the molecular formula C15H12FNO and a molecular weight of 241.27 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole
PubChem CID91326028
Molecular FormulaC15H12FNO
Molecular Weight241.27 g/mol
Exact Mass241.09
IUPAC Name5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole
SMILESFc1ccc(C2(c3ccccc3)CC=NO2)cc1
InChIInChI=1S/C15H12FNO/c16-14-8-6-13(7-9-14)15(10-11-17-18-15)12-4-2-1-3-5-12/h1-9,11H,10H2
InChIKeyULKOQNVFHBGETA-UHFFFAOYSA-N
XLogP3.48
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-(4-fluorophenyl)-5-phenyl-4H-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 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole?
The IUPAC name of 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole (CID 91326028) is 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole.
What is the SMILES notation for 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole?
The canonical SMILES for 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole is Fc1ccc(C2(c3ccccc3)CC=NO2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole?
The InChIKey is ULKOQNVFHBGETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO/c16-14-8-6-13(7-9-14)15(10-11-17-18-15)12-4-2-1-3-5-12/h1-9,11H,10H2.
What are the key properties of 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole?
5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole has a molecular weight of 241.27 g/mol, XLogP of 3.48, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-5-phenyl-4H-1,2-oxazole is sourced from PubChem (CID 91326028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).