[1-(2-methoxyphenyl)triazol-4-yl]methanol

C10H11N3O2 — CID 594728

IUPAC[1-(2-methoxyphenyl)triazol-4-yl]methanol
SMILESCOc1ccccc1-n1cc(CO)nn1
InChIInChI=1S/C10H11N3O2/c1-15-10-5-3-2-4-9(10)13-6-8(7-14)11-12-13/h2-6,14H,7H2,1H3
InChIKeyHZBXDGBTRJCYLD-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.77
Rot. Bonds3

About [1-(2-methoxyphenyl)triazol-4-yl]methanol

[1-(2-methoxyphenyl)triazol-4-yl]methanol (PubChem CID 594728) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is [1-(2-methoxyphenyl)triazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(2-methoxyphenyl)triazol-4-yl]methanol
PubChem CID594728
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name[1-(2-methoxyphenyl)triazol-4-yl]methanol
SMILESCOc1ccccc1-n1cc(CO)nn1
InChIInChI=1S/C10H11N3O2/c1-15-10-5-3-2-4-9(10)13-6-8(7-14)11-12-13/h2-6,14H,7H2,1H3
InChIKeyHZBXDGBTRJCYLD-UHFFFAOYSA-N
XLogP0.77
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-(2-methoxyphenyl)triazol-4-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyphenyl)triazol-4-yl]methanol?
The IUPAC name of [1-(2-methoxyphenyl)triazol-4-yl]methanol (CID 594728) is [1-(2-methoxyphenyl)triazol-4-yl]methanol.
What is the SMILES notation for [1-(2-methoxyphenyl)triazol-4-yl]methanol?
The canonical SMILES for [1-(2-methoxyphenyl)triazol-4-yl]methanol is COc1ccccc1-n1cc(CO)nn1.
What is the InChIKey of [1-(2-methoxyphenyl)triazol-4-yl]methanol?
The InChIKey is HZBXDGBTRJCYLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-15-10-5-3-2-4-9(10)13-6-8(7-14)11-12-13/h2-6,14H,7H2,1H3.
What are the key properties of [1-(2-methoxyphenyl)triazol-4-yl]methanol?
[1-(2-methoxyphenyl)triazol-4-yl]methanol has a molecular weight of 205.22 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyphenyl)triazol-4-yl]methanol is sourced from PubChem (CID 594728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).