[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol

C15H11FN2O2 — CID 63845064

IUPAC[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol
SMILESOC(c1ccccc1)c1nc(-c2ccccc2F)no1
InChIInChI=1S/C15H11FN2O2/c16-12-9-5-4-8-11(12)14-17-15(20-18-14)13(19)10-6-2-1-3-7-10/h1-9,13,19H
InChIKeyBRBDBYPCIJIAMZ-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.96
Rot. Bonds3

About [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol

[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol (PubChem CID 63845064) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol.

Molecular Properties

Compound Name[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol
PubChem CID63845064
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC Name[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol
SMILESOC(c1ccccc1)c1nc(-c2ccccc2F)no1
InChIInChI=1S/C15H11FN2O2/c16-12-9-5-4-8-11(12)14-17-15(20-18-14)13(19)10-6-2-1-3-7-10/h1-9,13,19H
InChIKeyBRBDBYPCIJIAMZ-UHFFFAOYSA-N
XLogP2.96
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol?
The IUPAC name of [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol (CID 63845064) is [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol.
What is the SMILES notation for [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol?
The canonical SMILES for [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol is OC(c1ccccc1)c1nc(-c2ccccc2F)no1.
What is the InChIKey of [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol?
The InChIKey is BRBDBYPCIJIAMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c16-12-9-5-4-8-11(12)14-17-15(20-18-14)13(19)10-6-2-1-3-7-10/h1-9,13,19H.
What are the key properties of [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol?
[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol has a molecular weight of 270.26 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-phenylmethanol is sourced from PubChem (CID 63845064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).