[3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine

C13H19N5 — CID 117145672

IUPAC[3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
SMILESCN1CCC(c2nnc3c(CN)cccn23)CC1
InChIInChI=1S/C13H19N5/c1-17-7-4-10(5-8-17)12-15-16-13-11(9-14)3-2-6-18(12)13/h2-3,6,10H,4-5,7-9,14H2,1H3
InChIKeyQLJLDCVGVDCZFV-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.00
Rot. Bonds2

About [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine

[3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine (PubChem CID 117145672) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine.

Molecular Properties

Compound Name[3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
PubChem CID117145672
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name[3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
SMILESCN1CCC(c2nnc3c(CN)cccn23)CC1
InChIInChI=1S/C13H19N5/c1-17-7-4-10(5-8-17)12-15-16-13-11(9-14)3-2-6-18(12)13/h2-3,6,10H,4-5,7-9,14H2,1H3
InChIKeyQLJLDCVGVDCZFV-UHFFFAOYSA-N
XLogP1.00
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-(oxan-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
CID 117145664
[3-[(1-methylpyrrolidin-3-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
CID 117145686
[3-(thiolan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
CID 117145724
3-(1-propan-2-ylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 117146304
3-(1-ethylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146249
8-bromo-3-(1-ethylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117146253
3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 58074688
[2-(1-methylazepan-4-yl)phenyl]methanamine
CID 83836854
[3-[(1-ethylpiperidin-3-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine
CID 117145787
[3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridin-7-yl]methanamine
CID 117143204
(3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)methanamine
CID 82054849
8-bromo-3-cyclohexyl-[1,2,4]triazolo[4,3-a]pyridine
CID 15754782

Frequently Asked Questions

What is the IUPAC name of [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine?
The IUPAC name of [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine (CID 117145672) is [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine.
What is the SMILES notation for [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine?
The canonical SMILES for [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine is CN1CCC(c2nnc3c(CN)cccn23)CC1.
What is the InChIKey of [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine?
The InChIKey is QLJLDCVGVDCZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-17-7-4-10(5-8-17)12-15-16-13-11(9-14)3-2-6-18(12)13/h2-3,6,10H,4-5,7-9,14H2,1H3.
What are the key properties of [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine?
[3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine has a molecular weight of 245.33 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanamine is sourced from PubChem (CID 117145672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).