8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine

C10H10ClN3O — CID 117146489

IUPAC8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESClc1cccn2c(C3CCCO3)nnc12
InChIInChI=1S/C10H10ClN3O/c11-7-3-1-5-14-9(7)12-13-10(14)8-4-2-6-15-8/h1,3,5,8H,2,4,6H2
InChIKeyMOGFTXRLCPIVAV-UHFFFAOYSA-N
MW223.66 g/mol
LogP2.23
Rot. Bonds1

About 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine

8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 117146489) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID117146489
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC Name8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESClc1cccn2c(C3CCCO3)nnc12
InChIInChI=1S/C10H10ClN3O/c11-7-3-1-5-14-9(7)12-13-10(14)8-4-2-6-15-8/h1,3,5,8H,2,4,6H2
InChIKeyMOGFTXRLCPIVAV-UHFFFAOYSA-N
XLogP2.23
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine (CID 117146489) is 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine is Clc1cccn2c(C3CCCO3)nnc12.
What is the InChIKey of 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is MOGFTXRLCPIVAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c11-7-3-1-5-14-9(7)12-13-10(14)8-4-2-6-15-8/h1,3,5,8H,2,4,6H2.
What are the key properties of 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine?
8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 223.66 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-3-(oxolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 117146489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).