2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol

C7H8N4O — CID 25248177

IUPAC2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol
SMILESOCCc1cnc2ncnn2c1
InChIInChI=1S/C7H8N4O/c12-2-1-6-3-8-7-9-5-10-11(7)4-6/h3-5,12H,1-2H2
InChIKeyQQRXAPDUQYJTJO-UHFFFAOYSA-N
MW164.17 g/mol
LogP-0.34
Rot. Bonds2

About 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol

2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol (PubChem CID 25248177) has the molecular formula C7H8N4O and a molecular weight of 164.17 g/mol. Its IUPAC name is 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol.

Molecular Properties

Compound Name2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol
PubChem CID25248177
Molecular FormulaC7H8N4O
Molecular Weight164.17 g/mol
Exact Mass164.07
IUPAC Name2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol
SMILESOCCc1cnc2ncnn2c1
InChIInChI=1S/C7H8N4O/c12-2-1-6-3-8-7-9-5-10-11(7)4-6/h3-5,12H,1-2H2
InChIKeyQQRXAPDUQYJTJO-UHFFFAOYSA-N
XLogP-0.34
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.17
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol 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 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol?
The IUPAC name of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol (CID 25248177) is 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol.
What is the SMILES notation for 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol?
The canonical SMILES for 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol is OCCc1cnc2ncnn2c1.
What is the InChIKey of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol?
The InChIKey is QQRXAPDUQYJTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O/c12-2-1-6-3-8-7-9-5-10-11(7)4-6/h3-5,12H,1-2H2.
What are the key properties of 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol?
2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol has a molecular weight of 164.17 g/mol, XLogP of -0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanol is sourced from PubChem (CID 25248177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).