3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine

C5H8N6 — CID 141134889

IUPAC3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine
SMILESCc1nn(N)c2c(N)ncn12
InChIInChI=1S/C5H8N6/c1-3-9-11(7)5-4(6)8-2-10(3)5/h2H,6-7H2,1H3
InChIKeyQPPYVXHUTOINDG-UHFFFAOYSA-N
MW152.16 g/mol
LogP-0.86
Rot. Bonds

About 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine

3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine (PubChem CID 141134889) has the molecular formula C5H8N6 and a molecular weight of 152.16 g/mol. Its IUPAC name is 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine.

Molecular Properties

Compound Name3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine
PubChem CID141134889
Molecular FormulaC5H8N6
Molecular Weight152.16 g/mol
Exact Mass152.08
IUPAC Name3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine
SMILESCc1nn(N)c2c(N)ncn12
InChIInChI=1S/C5H8N6/c1-3-9-11(7)5-4(6)8-2-10(3)5/h2H,6-7H2,1H3
InChIKeyQPPYVXHUTOINDG-UHFFFAOYSA-N
XLogP-0.86
TPSA87.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine 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

1-ethoxy-2,3-dimethylimidazo[1,5-a]imidazol-7-amine
CID 69459147
1-methoxyimidazo[1,5-b][1,2,4]triazol-7-amine
CID 69463464
5-bromoimidazo[1,5-a]pyridin-1-amine
CID 83867437
4,5-dimethylpyrazole-1,3-diamine
CID 126508760
1-methylimidazole-4,5-diamine;hydrochloride
CID 55288566
[1,2,4]triazolo[4,3-c]triazole-1,7-diamine
CID 69459678
5-chloro-1-methylimidazol-4-amine
CID 23064494
8-N,8-N,5-trimethylimidazo[1,2-c]pyrimidine-7,8-diamine
CID 163616168
8-methylimidazo[1,5-a]pyridin-1-amine
CID 83864990
imidazo[1,5-c]triazole-1,4-diamine
CID 55285068
imidazo[1,5-b]pyrazole-1,4-diamine
CID 55284505
3-(2-amino-5-methyl-1H-imidazol-4-yl)imidazo[5,1-b][1,3]thiazol-7-amine
CID 82389723

Frequently Asked Questions

What is the IUPAC name of 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine?
The IUPAC name of 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine (CID 141134889) is 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine.
What is the SMILES notation for 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine?
The canonical SMILES for 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine is Cc1nn(N)c2c(N)ncn12.
What is the InChIKey of 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine?
The InChIKey is QPPYVXHUTOINDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N6/c1-3-9-11(7)5-4(6)8-2-10(3)5/h2H,6-7H2,1H3.
What are the key properties of 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine?
3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine has a molecular weight of 152.16 g/mol, XLogP of -0.86, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylimidazo[5,1-c][1,2,4]triazole-1,7-diamine is sourced from PubChem (CID 141134889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).