1-phenyl-2-(triazol-2-yl)ethanol

C10H11N3O — CID 6481684

IUPAC1-phenyl-2-(triazol-2-yl)ethanol
SMILESOC(Cn1nccn1)c1ccccc1
InChIInChI=1S/C10H11N3O/c14-10(8-13-11-6-7-12-13)9-4-2-1-3-5-9/h1-7,10,14H,8H2
InChIKeyGDWNORHMCZZDKQ-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.01
Rot. Bonds3

About 1-phenyl-2-(triazol-2-yl)ethanol

1-phenyl-2-(triazol-2-yl)ethanol (PubChem CID 6481684) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-phenyl-2-(triazol-2-yl)ethanol.

Molecular Properties

Compound Name1-phenyl-2-(triazol-2-yl)ethanol
PubChem CID6481684
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-phenyl-2-(triazol-2-yl)ethanol
SMILESOC(Cn1nccn1)c1ccccc1
InChIInChI=1S/C10H11N3O/c14-10(8-13-11-6-7-12-13)9-4-2-1-3-5-9/h1-7,10,14H,8H2
InChIKeyGDWNORHMCZZDKQ-UHFFFAOYSA-N
XLogP1.01
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(triazol-2-yl)ethanol?
The IUPAC name of 1-phenyl-2-(triazol-2-yl)ethanol (CID 6481684) is 1-phenyl-2-(triazol-2-yl)ethanol.
What is the SMILES notation for 1-phenyl-2-(triazol-2-yl)ethanol?
The canonical SMILES for 1-phenyl-2-(triazol-2-yl)ethanol is OC(Cn1nccn1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(triazol-2-yl)ethanol?
The InChIKey is GDWNORHMCZZDKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-10(8-13-11-6-7-12-13)9-4-2-1-3-5-9/h1-7,10,14H,8H2.
What are the key properties of 1-phenyl-2-(triazol-2-yl)ethanol?
1-phenyl-2-(triazol-2-yl)ethanol has a molecular weight of 189.22 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(triazol-2-yl)ethanol is sourced from PubChem (CID 6481684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).