2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

C12H17N5 — CID 117132321

IUPAC2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESNc1cccc2nc(CC3CCCNC3)nn12
InChIInChI=1S/C12H17N5/c13-10-4-1-5-12-15-11(16-17(10)12)7-9-3-2-6-14-8-9/h1,4-5,9,14H,2-3,6-8,13H2
InChIKeyHIFSPBZJSTWVJW-UHFFFAOYSA-N
MW231.30 g/mol
LogP0.85
Rot. Bonds2

About 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (PubChem CID 117132321) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
PubChem CID117132321
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESNc1cccc2nc(CC3CCCNC3)nn12
InChIInChI=1S/C12H17N5/c13-10-4-1-5-12-15-11(16-17(10)12)7-9-3-2-6-14-8-9/h1,4-5,9,14H,2-3,6-8,13H2
InChIKeyHIFSPBZJSTWVJW-UHFFFAOYSA-N
XLogP0.85
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-(pyrrolidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117131417
2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 117136994
2-[(1-ethylpiperidin-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117131561
6-methyl-2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117130107
2-[(1-ethylpyrrolidin-3-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117131432
2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 117130058
2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid
CID 117130151
2-(azepan-1-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117257524
4,5,6-trimethyl-2-(piperidin-3-ylmethyl)pyrimidine
CID 105474903
2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 83866249
2-cyclopentyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 83866250
2-[[(3R)-piperidin-3-yl]methyl]-6-pyrrolidin-1-ylpyridine
CID 95846194

Frequently Asked Questions

What is the IUPAC name of 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The IUPAC name of 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (CID 117132321) is 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The canonical SMILES for 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is Nc1cccc2nc(CC3CCCNC3)nn12.
What is the InChIKey of 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The InChIKey is HIFSPBZJSTWVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c13-10-4-1-5-12-15-11(16-17(10)12)7-9-3-2-6-14-8-9/h1,4-5,9,14H,2-3,6-8,13H2.
What are the key properties of 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine has a molecular weight of 231.30 g/mol, XLogP of 0.85, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 117132321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).