triazolo[1,5-a]pyrimidin-6-ol

C5H4N4O — CID 57096157

IUPACtriazolo[1,5-a]pyrimidin-6-ol
SMILESOc1cnc2cnnn2c1
InChIInChI=1S/C5H4N4O/c10-4-1-6-5-2-7-8-9(5)3-4/h1-3,10H
InChIKeyIJVQOHLCZSNGPR-UHFFFAOYSA-N
MW136.11 g/mol
LogP-0.17
Rot. Bonds

About triazolo[1,5-a]pyrimidin-6-ol

triazolo[1,5-a]pyrimidin-6-ol (PubChem CID 57096157) has the molecular formula C5H4N4O and a molecular weight of 136.11 g/mol. Its IUPAC name is triazolo[1,5-a]pyrimidin-6-ol.

Molecular Properties

Compound Nametriazolo[1,5-a]pyrimidin-6-ol
PubChem CID57096157
Molecular FormulaC5H4N4O
Molecular Weight136.11 g/mol
Exact Mass136.04
IUPAC Nametriazolo[1,5-a]pyrimidin-6-ol
SMILESOc1cnc2cnnn2c1
InChIInChI=1S/C5H4N4O/c10-4-1-6-5-2-7-8-9(5)3-4/h1-3,10H
InChIKeyIJVQOHLCZSNGPR-UHFFFAOYSA-N
XLogP-0.17
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.11
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of triazolo[1,5-a]pyrimidin-6-ol?
The IUPAC name of triazolo[1,5-a]pyrimidin-6-ol (CID 57096157) is triazolo[1,5-a]pyrimidin-6-ol.
What is the SMILES notation for triazolo[1,5-a]pyrimidin-6-ol?
The canonical SMILES for triazolo[1,5-a]pyrimidin-6-ol is Oc1cnc2cnnn2c1.
What is the InChIKey of triazolo[1,5-a]pyrimidin-6-ol?
The InChIKey is IJVQOHLCZSNGPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N4O/c10-4-1-6-5-2-7-8-9(5)3-4/h1-3,10H.
What are the key properties of triazolo[1,5-a]pyrimidin-6-ol?
triazolo[1,5-a]pyrimidin-6-ol has a molecular weight of 136.11 g/mol, XLogP of -0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triazolo[1,5-a]pyrimidin-6-ol is sourced from PubChem (CID 57096157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).