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

C14H9FN2O — CID 2876651

IUPAC5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole
SMILESFc1ccccc1-c1nc(-c2ccccc2)no1
InChIInChI=1S/C14H9FN2O/c15-12-9-5-4-8-11(12)14-16-13(17-18-14)10-6-2-1-3-7-10/h1-9H
InChIKeyKHDXKUPLQGEWMA-UHFFFAOYSA-N
MW240.24 g/mol
LogP3.54
Rot. Bonds2

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

5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole (PubChem CID 2876651) has the molecular formula C14H9FN2O and a molecular weight of 240.24 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole
PubChem CID2876651
Molecular FormulaC14H9FN2O
Molecular Weight240.24 g/mol
Exact Mass240.07
IUPAC Name5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole
SMILESFc1ccccc1-c1nc(-c2ccccc2)no1
InChIInChI=1S/C14H9FN2O/c15-12-9-5-4-8-11(12)14-16-13(17-18-14)10-6-2-1-3-7-10/h1-9H
InChIKeyKHDXKUPLQGEWMA-UHFFFAOYSA-N
XLogP3.54
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.24
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole?
The IUPAC name of 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole (CID 2876651) is 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole?
The canonical SMILES for 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole is Fc1ccccc1-c1nc(-c2ccccc2)no1.
What is the InChIKey of 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole?
The InChIKey is KHDXKUPLQGEWMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O/c15-12-9-5-4-8-11(12)14-16-13(17-18-14)10-6-2-1-3-7-10/h1-9H.
What are the key properties of 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole?
5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole has a molecular weight of 240.24 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-3-phenyl-1,2,4-oxadiazole is sourced from PubChem (CID 2876651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).