2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one

C10H11N3O2 — CID 117134152

IUPAC2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
SMILESO=c1ccn2[nH]c(C3CCCO3)nc2c1
InChIInChI=1S/C10H11N3O2/c14-7-3-4-13-9(6-7)11-10(12-13)8-2-1-5-15-8/h3-4,6,8H,1-2,5H2,(H,11,12)
InChIKeyJZTNTAOPIXZBBW-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.87
Rot. Bonds1

About 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one

2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one (PubChem CID 117134152) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one.

Molecular Properties

Compound Name2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
PubChem CID117134152
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
SMILESO=c1ccn2[nH]c(C3CCCO3)nc2c1
InChIInChI=1S/C10H11N3O2/c14-7-3-4-13-9(6-7)11-10(12-13)8-2-1-5-15-8/h3-4,6,8H,1-2,5H2,(H,11,12)
InChIKeyJZTNTAOPIXZBBW-UHFFFAOYSA-N
XLogP0.87
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
The IUPAC name of 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one (CID 117134152) is 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one.
What is the SMILES notation for 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
The canonical SMILES for 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one is O=c1ccn2[nH]c(C3CCCO3)nc2c1.
What is the InChIKey of 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
The InChIKey is JZTNTAOPIXZBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c14-7-3-4-13-9(6-7)11-10(12-13)8-2-1-5-15-8/h3-4,6,8H,1-2,5H2,(H,11,12).
What are the key properties of 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one has a molecular weight of 205.22 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one is sourced from PubChem (CID 117134152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).