[3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine

C14H21N5 — CID 117140939

IUPAC[3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine
SMILESNCc1cccc2nnc(CCN3CCCCC3)n12
InChIInChI=1S/C14H21N5/c15-11-12-5-4-6-13-16-17-14(19(12)13)7-10-18-8-2-1-3-9-18/h4-6H,1-3,7-11,15H2
InChIKeyNDFNCUFAYBIRRO-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.22
Rot. Bonds4

About [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine

[3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine (PubChem CID 117140939) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine.

Molecular Properties

Compound Name[3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine
PubChem CID117140939
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name[3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine
SMILESNCc1cccc2nnc(CCN3CCCCC3)n12
InChIInChI=1S/C14H21N5/c15-11-12-5-4-6-13-16-17-14(19(12)13)7-10-18-8-2-1-3-9-18/h4-6H,1-3,7-11,15H2
InChIKeyNDFNCUFAYBIRRO-UHFFFAOYSA-N
XLogP1.22
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine with MolForge

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Related Compounds

3-(2-morpholin-4-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117142384
4-[2-(5-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]morpholine
CID 117142388
[3-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine
CID 117140724
3-(pyrrolidin-1-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117256946
3,5-diethyl-[1,2,4]triazolo[4,3-a]pyridine
CID 66849171
2-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridin-5-amine
CID 117133268
3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol
CID 117142363
1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-amine
CID 117400107
3-(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)propan-1-amine
CID 105447953
3-(2-piperidin-1-ylethyl)pyridazine
CID 154363673
7-methoxy-3-(2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117143174
2-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanamine
CID 83866670

Frequently Asked Questions

What is the IUPAC name of [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine?
The IUPAC name of [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine (CID 117140939) is [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine.
What is the SMILES notation for [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine?
The canonical SMILES for [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine is NCc1cccc2nnc(CCN3CCCCC3)n12.
What is the InChIKey of [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine?
The InChIKey is NDFNCUFAYBIRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c15-11-12-5-4-6-13-16-17-14(19(12)13)7-10-18-8-2-1-3-9-18/h4-6H,1-3,7-11,15H2.
What are the key properties of [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine?
[3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine has a molecular weight of 259.36 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridin-5-yl]methanamine is sourced from PubChem (CID 117140939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).