[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol

C20H15FN4O — CID 73052844

IUPAC[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol
SMILESOCc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F
InChIInChI=1S/C20H15FN4O/c21-18-11-5-6-12-19(18)25-20(22-23-24-25)17-10-4-3-9-16(17)15-8-2-1-7-14(15)13-26/h1-12,26H,13H2
InChIKeyLEAUQIRBUGLNIO-UHFFFAOYSA-N
MW346.37 g/mol
LogP3.63
Rot. Bonds4

About [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol

[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol (PubChem CID 73052844) has the molecular formula C20H15FN4O and a molecular weight of 346.37 g/mol. Its IUPAC name is [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol
PubChem CID73052844
Molecular FormulaC20H15FN4O
Molecular Weight346.37 g/mol
Exact Mass346.12
IUPAC Name[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol
SMILESOCc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F
InChIInChI=1S/C20H15FN4O/c21-18-11-5-6-12-19(18)25-20(22-23-24-25)17-10-4-3-9-16(17)15-8-2-1-7-14(15)13-26/h1-12,26H,13H2
InChIKeyLEAUQIRBUGLNIO-UHFFFAOYSA-N
XLogP3.63
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol?
The IUPAC name of [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol (CID 73052844) is [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol.
What is the SMILES notation for [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol?
The canonical SMILES for [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol is OCc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F.
What is the InChIKey of [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol?
The InChIKey is LEAUQIRBUGLNIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN4O/c21-18-11-5-6-12-19(18)25-20(22-23-24-25)17-10-4-3-9-16(17)15-8-2-1-7-14(15)13-26/h1-12,26H,13H2.
What are the key properties of [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol?
[2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol has a molecular weight of 346.37 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[1-(2-fluorophenyl)tetrazol-5-yl]phenyl]phenyl]methanol is sourced from PubChem (CID 73052844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).