3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine

C10H7N3O — CID 4730542

IUPAC3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESc1coc(-c2nnc3ccccn23)c1
InChIInChI=1S/C10H7N3O/c1-2-6-13-9(5-1)11-12-10(13)8-4-3-7-14-8/h1-7H
InChIKeyMHHLHKMUMIBULZ-UHFFFAOYSA-N
MW185.19 g/mol
LogP1.99
Rot. Bonds1

About 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine

3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 4730542) has the molecular formula C10H7N3O and a molecular weight of 185.19 g/mol. Its IUPAC name is 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID4730542
Molecular FormulaC10H7N3O
Molecular Weight185.19 g/mol
Exact Mass185.06
IUPAC Name3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESc1coc(-c2nnc3ccccn23)c1
InChIInChI=1S/C10H7N3O/c1-2-6-13-9(5-1)11-12-10(13)8-4-3-7-14-8/h1-7H
InChIKeyMHHLHKMUMIBULZ-UHFFFAOYSA-N
XLogP1.99
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine (CID 4730542) is 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine is c1coc(-c2nnc3ccccn23)c1.
What is the InChIKey of 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is MHHLHKMUMIBULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O/c1-2-6-13-9(5-1)11-12-10(13)8-4-3-7-14-8/h1-7H.
What are the key properties of 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 185.19 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 4730542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).