5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine

C14H21N5 — CID 116989562

IUPAC5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1cccc2nc(CC(C)N3CCNCC3)nn12
InChIInChI=1S/C14H21N5/c1-11-4-3-5-14-16-13(17-19(11)14)10-12(2)18-8-6-15-7-9-18/h3-5,12,15H,6-10H2,1-2H3
InChIKeyAYLBZHQYXLMKEO-UHFFFAOYSA-N
MW259.36 g/mol
LogP0.87
Rot. Bonds3

About 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine

5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 116989562) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID116989562
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1cccc2nc(CC(C)N3CCNCC3)nn12
InChIInChI=1S/C14H21N5/c1-11-4-3-5-14-16-13(17-19(11)14)10-12(2)18-8-6-15-7-9-18/h3-5,12,15H,6-10H2,1-2H3
InChIKeyAYLBZHQYXLMKEO-UHFFFAOYSA-N
XLogP0.87
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-bromo-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 116990080
1-[1-(6-methyl-2-pyridinyl)propan-2-yl]piperazine
CID 83889116
1-[1-(3-bromophenyl)propan-2-yl]piperazine
CID 82024249
4-[(5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methyl]aniline
CID 83966917
1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine
CID 82289927
2-methyl-6-(2-piperazin-1-ylpropyl)-1,3-benzoxazole
CID 82500389
3-(2-piperazin-1-ylpropyl)-1H-pyridin-2-one
CID 83890200
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 115314720
2-methyl-3-(2-piperazin-1-ylpropyl)indolizine
CID 116993695
N-methyl-3-piperazin-1-yl-1-thiophen-2-ylbutan-1-amine
CID 116960914
1-[1-(2-methoxy-4,5-dimethylphenyl)propan-2-yl]piperazine
CID 82302972
1-(3-bromophenyl)-N-methyl-3-piperazin-1-ylbutan-1-amine
CID 116960927

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 116989562) is 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1cccc2nc(CC(C)N3CCNCC3)nn12.
What is the InChIKey of 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is AYLBZHQYXLMKEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-11-4-3-5-14-16-13(17-19(11)14)10-12(2)18-8-6-15-7-9-18/h3-5,12,15H,6-10H2,1-2H3.
What are the key properties of 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine?
5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 259.36 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 116989562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).