1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol

C10H10FN3O — CID 6481687

IUPAC1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol
SMILESOC(Cn1nccn1)c1ccc(F)cc1
InChIInChI=1S/C10H10FN3O/c11-9-3-1-8(2-4-9)10(15)7-14-12-5-6-13-14/h1-6,10,15H,7H2
InChIKeyLOOXFJRZHHQNBU-UHFFFAOYSA-N
MW207.21 g/mol
LogP1.15
Rot. Bonds3

About 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol

1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol (PubChem CID 6481687) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol
PubChem CID6481687
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol
SMILESOC(Cn1nccn1)c1ccc(F)cc1
InChIInChI=1S/C10H10FN3O/c11-9-3-1-8(2-4-9)10(15)7-14-12-5-6-13-14/h1-6,10,15H,7H2
InChIKeyLOOXFJRZHHQNBU-UHFFFAOYSA-N
XLogP1.15
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol (CID 6481687) is 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol is OC(Cn1nccn1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol?
The InChIKey is LOOXFJRZHHQNBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c11-9-3-1-8(2-4-9)10(15)7-14-12-5-6-13-14/h1-6,10,15H,7H2.
What are the key properties of 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol?
1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol has a molecular weight of 207.21 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(triazol-2-yl)ethanol is sourced from PubChem (CID 6481687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).