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

C15H11FN2O — CID 2238983

IUPAC5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole
SMILESCc1ccccc1-c1noc(-c2ccccc2F)n1
InChIInChI=1S/C15H11FN2O/c1-10-6-2-3-7-11(10)14-17-15(19-18-14)12-8-4-5-9-13(12)16/h2-9H,1H3
InChIKeyGGLDHWHEVDMLBH-UHFFFAOYSA-N
MW254.26 g/mol
LogP3.85
Rot. Bonds2

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

5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole (PubChem CID 2238983) has the molecular formula C15H11FN2O and a molecular weight of 254.26 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole
PubChem CID2238983
Molecular FormulaC15H11FN2O
Molecular Weight254.26 g/mol
Exact Mass254.09
IUPAC Name5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole
SMILESCc1ccccc1-c1noc(-c2ccccc2F)n1
InChIInChI=1S/C15H11FN2O/c1-10-6-2-3-7-11(10)14-17-15(19-18-14)12-8-4-5-9-13(12)16/h2-9H,1H3
InChIKeyGGLDHWHEVDMLBH-UHFFFAOYSA-N
XLogP3.85
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 53.85
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-(2-methylphenyl)-1,2,4-oxadiazole?
The IUPAC name of 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole (CID 2238983) is 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole?
The canonical SMILES for 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole is Cc1ccccc1-c1noc(-c2ccccc2F)n1.
What is the InChIKey of 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole?
The InChIKey is GGLDHWHEVDMLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O/c1-10-6-2-3-7-11(10)14-17-15(19-18-14)12-8-4-5-9-13(12)16/h2-9H,1H3.
What are the key properties of 5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole?
5-(2-fluorophenyl)-3-(2-methylphenyl)-1,2,4-oxadiazole has a molecular weight of 254.26 g/mol, XLogP of 3.85, 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-(2-methylphenyl)-1,2,4-oxadiazole is sourced from PubChem (CID 2238983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).