[3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol

C10H10FN3O — CID 67498340

IUPAC[3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol
SMILESCc1nnn(-c2ccccc2F)c1CO
InChIInChI=1S/C10H10FN3O/c1-7-10(6-15)14(13-12-7)9-5-3-2-4-8(9)11/h2-5,15H,6H2,1H3
InChIKeyWNPCFXUATDPKNF-UHFFFAOYSA-N
MW207.21 g/mol
LogP1.21
Rot. Bonds2

About [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol

[3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol (PubChem CID 67498340) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol.

Molecular Properties

Compound Name[3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol
PubChem CID67498340
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name[3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol
SMILESCc1nnn(-c2ccccc2F)c1CO
InChIInChI=1S/C10H10FN3O/c1-7-10(6-15)14(13-12-7)9-5-3-2-4-8(9)11/h2-5,15H,6H2,1H3
InChIKeyWNPCFXUATDPKNF-UHFFFAOYSA-N
XLogP1.21
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol?
The IUPAC name of [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol (CID 67498340) is [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol.
What is the SMILES notation for [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol?
The canonical SMILES for [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol is Cc1nnn(-c2ccccc2F)c1CO.
What is the InChIKey of [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol?
The InChIKey is WNPCFXUATDPKNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-7-10(6-15)14(13-12-7)9-5-3-2-4-8(9)11/h2-5,15H,6H2,1H3.
What are the key properties of [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol?
[3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol has a molecular weight of 207.21 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluorophenyl)-5-methyltriazol-4-yl]methanol is sourced from PubChem (CID 67498340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).