2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine

C5H6N6 — CID 12666257

IUPAC2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
SMILESCc1nc2ncnc(N)n2n1
InChIInChI=1S/C5H6N6/c1-3-9-5-8-2-7-4(6)11(5)10-3/h2H,1H3,(H2,6,7,8,9,10)
InChIKeyACHFKTLOIJKHGY-UHFFFAOYSA-N
MW150.15 g/mol
LogP-0.59
Rot. Bonds

About 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine

2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine (PubChem CID 12666257) has the molecular formula C5H6N6 and a molecular weight of 150.15 g/mol. Its IUPAC name is 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine.

Molecular Properties

Compound Name2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
PubChem CID12666257
Molecular FormulaC5H6N6
Molecular Weight150.15 g/mol
Exact Mass150.07
IUPAC Name2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
SMILESCc1nc2ncnc(N)n2n1
InChIInChI=1S/C5H6N6/c1-3-9-5-8-2-7-4(6)11(5)10-3/h2H,1H3,(H2,6,7,8,9,10)
InChIKeyACHFKTLOIJKHGY-UHFFFAOYSA-N
XLogP-0.59
TPSA81.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.15
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine?
The IUPAC name of 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine (CID 12666257) is 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine.
What is the SMILES notation for 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine?
The canonical SMILES for 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine is Cc1nc2ncnc(N)n2n1.
What is the InChIKey of 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine?
The InChIKey is ACHFKTLOIJKHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N6/c1-3-9-5-8-2-7-4(6)11(5)10-3/h2H,1H3,(H2,6,7,8,9,10).
What are the key properties of 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine?
2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine has a molecular weight of 150.15 g/mol, XLogP of -0.59, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine is sourced from PubChem (CID 12666257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).