5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole

C14H8F2N2O — CID 91528540

IUPAC5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole
SMILESFc1cccc(-c2cc(F)cc(-c3ncno3)c2)c1
InChIInChI=1S/C14H8F2N2O/c15-12-3-1-2-9(5-12)10-4-11(7-13(16)6-10)14-17-8-18-19-14/h1-8H
InChIKeyHNDCVTQARAFIAK-UHFFFAOYSA-N
MW258.23 g/mol
LogP3.68
Rot. Bonds2

About 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole

5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole (PubChem CID 91528540) has the molecular formula C14H8F2N2O and a molecular weight of 258.23 g/mol. Its IUPAC name is 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole
PubChem CID91528540
Molecular FormulaC14H8F2N2O
Molecular Weight258.23 g/mol
Exact Mass258.06
IUPAC Name5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole
SMILESFc1cccc(-c2cc(F)cc(-c3ncno3)c2)c1
InChIInChI=1S/C14H8F2N2O/c15-12-3-1-2-9(5-12)10-4-11(7-13(16)6-10)14-17-8-18-19-14/h1-8H
InChIKeyHNDCVTQARAFIAK-UHFFFAOYSA-N
XLogP3.68
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.23
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole 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-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole?
The IUPAC name of 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole (CID 91528540) is 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole.
What is the SMILES notation for 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole?
The canonical SMILES for 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole is Fc1cccc(-c2cc(F)cc(-c3ncno3)c2)c1.
What is the InChIKey of 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole?
The InChIKey is HNDCVTQARAFIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F2N2O/c15-12-3-1-2-9(5-12)10-4-11(7-13(16)6-10)14-17-8-18-19-14/h1-8H.
What are the key properties of 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole?
5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole has a molecular weight of 258.23 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole is sourced from PubChem (CID 91528540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).