3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine

C8H13N3 — CID 89233350

IUPAC3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCCc1nnc2n1CCCC2
InChIInChI=1S/C8H13N3/c1-2-7-9-10-8-5-3-4-6-11(7)8/h2-6H2,1H3
InChIKeyRSTUNNHNAQETCY-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.18
Rot. Bonds1

About 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine

3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 89233350) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID89233350
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCCc1nnc2n1CCCC2
InChIInChI=1S/C8H13N3/c1-2-7-9-10-8-5-3-4-6-11(7)8/h2-6H2,1H3
InChIKeyRSTUNNHNAQETCY-UHFFFAOYSA-N
XLogP1.18
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine (CID 89233350) is 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine is CCc1nnc2n1CCCC2.
What is the InChIKey of 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is RSTUNNHNAQETCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-2-7-9-10-8-5-3-4-6-11(7)8/h2-6H2,1H3.
What are the key properties of 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 151.21 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 89233350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).