N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine

C15H16N4O — CID 90671746

IUPACN-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCOc1ccc(CCNc2cccn3ncnc23)cc1
InChIInChI=1S/C15H16N4O/c1-20-13-6-4-12(5-7-13)8-9-16-14-3-2-10-19-15(14)17-11-18-19/h2-7,10-11,16H,8-9H2,1H3
InChIKeyOFRXKDUVEBWAMJ-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.39
Rot. Bonds5

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

N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine (PubChem CID 90671746) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine
PubChem CID90671746
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCOc1ccc(CCNc2cccn3ncnc23)cc1
InChIInChI=1S/C15H16N4O/c1-20-13-6-4-12(5-7-13)8-9-16-14-3-2-10-19-15(14)17-11-18-19/h2-7,10-11,16H,8-9H2,1H3
InChIKeyOFRXKDUVEBWAMJ-UHFFFAOYSA-N
XLogP2.39
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine (CID 90671746) is N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine.
What is the SMILES notation for N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The canonical SMILES for N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine is COc1ccc(CCNc2cccn3ncnc23)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The InChIKey is OFRXKDUVEBWAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-20-13-6-4-12(5-7-13)8-9-16-14-3-2-10-19-15(14)17-11-18-19/h2-7,10-11,16H,8-9H2,1H3.
What are the key properties of N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine has a molecular weight of 268.32 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 90671746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).