3H-[1,2,4]triazolo[1,5-a]pyridin-5-one

C6H5N3O — CID 91608405

IUPAC3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
SMILESO=c1cccc2nc[nH]n12
InChIInChI=1S/C6H5N3O/c10-6-3-1-2-5-7-4-8-9(5)6/h1-4H,(H,7,8)
InChIKeyJXZDBLJUNZKOCY-UHFFFAOYSA-N
MW135.13 g/mol
LogP0.02
Rot. Bonds

About 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one

3H-[1,2,4]triazolo[1,5-a]pyridin-5-one (PubChem CID 91608405) has the molecular formula C6H5N3O and a molecular weight of 135.13 g/mol. Its IUPAC name is 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one.

Molecular Properties

Compound Name3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
PubChem CID91608405
Molecular FormulaC6H5N3O
Molecular Weight135.13 g/mol
Exact Mass135.04
IUPAC Name3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
SMILESO=c1cccc2nc[nH]n12
InChIInChI=1S/C6H5N3O/c10-6-3-1-2-5-7-4-8-9(5)6/h1-4H,(H,7,8)
InChIKeyJXZDBLJUNZKOCY-UHFFFAOYSA-N
XLogP0.02
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.13
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-Methyl-(1,2,4)triazolo(1,5-a)pyridin-5-ol
CID 4855592
2-bromo-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
CID 70908949
ethane;3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
CID 172614898
2-amino-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
CID 105429402
2-methyl-3H-[1,2,4]triazolo[1,5-a]pyridin-5-one
CID 117132938

Frequently Asked Questions

What is the IUPAC name of 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The IUPAC name of 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one (CID 91608405) is 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one.
What is the SMILES notation for 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The canonical SMILES for 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one is O=c1cccc2nc[nH]n12.
What is the InChIKey of 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
The InChIKey is JXZDBLJUNZKOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O/c10-6-3-1-2-5-7-4-8-9(5)6/h1-4H,(H,7,8).
What are the key properties of 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one?
3H-[1,2,4]triazolo[1,5-a]pyridin-5-one has a molecular weight of 135.13 g/mol, XLogP of 0.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-[1,2,4]triazolo[1,5-a]pyridin-5-one is sourced from PubChem (CID 91608405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).