5H-imidazo[4,5-d]triazin-4-amine

C4H4N6 — CID 5480214

IUPAC5H-imidazo[4,5-d]triazin-4-amine
SMILESNc1nnnc2nc[nH]c12
InChIInChI=1S/C4H4N6/c5-3-2-4(7-1-6-2)9-10-8-3/h1H,(H3,5,6,7,8,9)
InChIKeyQHVZREGCOXMZPG-UHFFFAOYSA-N
MW136.12 g/mol
LogP-0.67
Rot. Bonds

About 5H-imidazo[4,5-d]triazin-4-amine

5H-imidazo[4,5-d]triazin-4-amine (PubChem CID 5480214) has the molecular formula C4H4N6 and a molecular weight of 136.12 g/mol. Its IUPAC name is 5H-imidazo[4,5-d]triazin-4-amine.

Molecular Properties

Compound Name5H-imidazo[4,5-d]triazin-4-amine
PubChem CID5480214
Molecular FormulaC4H4N6
Molecular Weight136.12 g/mol
Exact Mass136.05
IUPAC Name5H-imidazo[4,5-d]triazin-4-amine
SMILESNc1nnnc2nc[nH]c12
InChIInChI=1S/C4H4N6/c5-3-2-4(7-1-6-2)9-10-8-3/h1H,(H3,5,6,7,8,9)
InChIKeyQHVZREGCOXMZPG-UHFFFAOYSA-N
XLogP-0.67
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.12
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5H-imidazo[4,5-d]triazin-4-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 5H-imidazo[4,5-d]triazin-4-amine?
The IUPAC name of 5H-imidazo[4,5-d]triazin-4-amine (CID 5480214) is 5H-imidazo[4,5-d]triazin-4-amine.
What is the SMILES notation for 5H-imidazo[4,5-d]triazin-4-amine?
The canonical SMILES for 5H-imidazo[4,5-d]triazin-4-amine is Nc1nnnc2nc[nH]c12.
What is the InChIKey of 5H-imidazo[4,5-d]triazin-4-amine?
The InChIKey is QHVZREGCOXMZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N6/c5-3-2-4(7-1-6-2)9-10-8-3/h1H,(H3,5,6,7,8,9).
What are the key properties of 5H-imidazo[4,5-d]triazin-4-amine?
5H-imidazo[4,5-d]triazin-4-amine has a molecular weight of 136.12 g/mol, XLogP of -0.67, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-imidazo[4,5-d]triazin-4-amine is sourced from PubChem (CID 5480214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).