2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol

C10H11N3O — CID 117137741

IUPAC2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol
SMILESOc1cccn2nc(C3CCC3)nc12
InChIInChI=1S/C10H11N3O/c14-8-5-2-6-13-10(8)11-9(12-13)7-3-1-4-7/h2,5-7,14H,1,3-4H2
InChIKeyOADSYHUUXJBMDZ-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.70
Rot. Bonds1

About 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol

2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol (PubChem CID 117137741) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol.

Molecular Properties

Compound Name2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol
PubChem CID117137741
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol
SMILESOc1cccn2nc(C3CCC3)nc12
InChIInChI=1S/C10H11N3O/c14-8-5-2-6-13-10(8)11-9(12-13)7-3-1-4-7/h2,5-7,14H,1,3-4H2
InChIKeyOADSYHUUXJBMDZ-UHFFFAOYSA-N
XLogP1.70
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol?
The IUPAC name of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol (CID 117137741) is 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol.
What is the SMILES notation for 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol?
The canonical SMILES for 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol is Oc1cccn2nc(C3CCC3)nc12.
What is the InChIKey of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol?
The InChIKey is OADSYHUUXJBMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-8-5-2-6-13-10(8)11-9(12-13)7-3-1-4-7/h2,5-7,14H,1,3-4H2.
What are the key properties of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol?
2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol has a molecular weight of 189.22 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-ol is sourced from PubChem (CID 117137741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).