7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine

C6H7N3 — CID 118369185

IUPAC7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESC1=Cn2cnnc2CC1
InChIInChI=1S/C6H7N3/c1-2-4-9-5-7-8-6(9)3-1/h2,4-5H,1,3H2
InChIKeyAPLAYLHQYGGORB-UHFFFAOYSA-N
MW121.14 g/mol
LogP0.69
Rot. Bonds

About 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine

7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 118369185) has the molecular formula C6H7N3 and a molecular weight of 121.14 g/mol. Its IUPAC name is 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID118369185
Molecular FormulaC6H7N3
Molecular Weight121.14 g/mol
Exact Mass121.06
IUPAC Name7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESC1=Cn2cnnc2CC1
InChIInChI=1S/C6H7N3/c1-2-4-9-5-7-8-6(9)3-1/h2,4-5H,1,3H2
InChIKeyAPLAYLHQYGGORB-UHFFFAOYSA-N
XLogP0.69
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.14
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (CID 118369185) is 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is C1=Cn2cnnc2CC1.
What is the InChIKey of 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is APLAYLHQYGGORB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3/c1-2-4-9-5-7-8-6(9)3-1/h2,4-5H,1,3H2.
What are the key properties of 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 121.14 g/mol, XLogP of 0.69, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 118369185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).