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

C14H20N4 — CID 63137902

IUPAC3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCCCC1(c2nnc3ccccn23)CCCNC1
InChIInChI=1S/C14H20N4/c1-2-7-14(8-5-9-15-11-14)13-17-16-12-6-3-4-10-18(12)13/h3-4,6,10,15H,2,5,7-9,11H2,1H3
InChIKeyJNTMOBWHHPDGBJ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.15
Rot. Bonds3

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

3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 63137902) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID63137902
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCCCC1(c2nnc3ccccn23)CCCNC1
InChIInChI=1S/C14H20N4/c1-2-7-14(8-5-9-15-11-14)13-17-16-12-6-3-4-10-18(12)13/h3-4,6,10,15H,2,5,7-9,11H2,1H3
InChIKeyJNTMOBWHHPDGBJ-UHFFFAOYSA-N
XLogP2.15
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine (CID 63137902) is 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine is CCCC1(c2nnc3ccccn23)CCCNC1.
What is the InChIKey of 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is JNTMOBWHHPDGBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-2-7-14(8-5-9-15-11-14)13-17-16-12-6-3-4-10-18(12)13/h3-4,6,10,15H,2,5,7-9,11H2,1H3.
What are the key properties of 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 244.34 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-propylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 63137902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).