2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

C7H9N5 — CID 82566665

IUPAC2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESNCc1nc2c(N)cccn2n1
InChIInChI=1S/C7H9N5/c8-4-6-10-7-5(9)2-1-3-12(7)11-6/h1-3H,4,8-9H2
InChIKeyPUVYFJKSJFYHCU-UHFFFAOYSA-N
MW163.18 g/mol
LogP-0.23
Rot. Bonds1

About 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (PubChem CID 82566665) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
PubChem CID82566665
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESNCc1nc2c(N)cccn2n1
InChIInChI=1S/C7H9N5/c8-4-6-10-7-5(9)2-1-3-12(7)11-6/h1-3H,4,8-9H2
InChIKeyPUVYFJKSJFYHCU-UHFFFAOYSA-N
XLogP-0.23
TPSA82.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The IUPAC name of 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (CID 82566665) is 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The canonical SMILES for 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is NCc1nc2c(N)cccn2n1.
What is the InChIKey of 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The InChIKey is PUVYFJKSJFYHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c8-4-6-10-7-5(9)2-1-3-12(7)11-6/h1-3H,4,8-9H2.
What are the key properties of 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine has a molecular weight of 163.18 g/mol, XLogP of -0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 82566665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).