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

C5H5N5 — CID 70221930

IUPAC7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine
SMILESCc1ncnc2ncnn12
InChIInChI=1S/C5H5N5/c1-4-6-2-7-5-8-3-9-10(4)5/h2-3H,1H3
InChIKeyBUVVPUWVZFVWNT-UHFFFAOYSA-N
MW135.13 g/mol
LogP-0.17
Rot. Bonds

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

7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine (PubChem CID 70221930) has the molecular formula C5H5N5 and a molecular weight of 135.13 g/mol. Its IUPAC name is 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine.

Molecular Properties

Compound Name7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine
PubChem CID70221930
Molecular FormulaC5H5N5
Molecular Weight135.13 g/mol
Exact Mass135.05
IUPAC Name7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine
SMILESCc1ncnc2ncnn12
InChIInChI=1S/C5H5N5/c1-4-6-2-7-5-8-3-9-10(4)5/h2-3H,1H3
InChIKeyBUVVPUWVZFVWNT-UHFFFAOYSA-N
XLogP-0.17
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.13
LogP ≤ 5-0.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine?
The IUPAC name of 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine (CID 70221930) is 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine.
What is the SMILES notation for 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine?
The canonical SMILES for 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine is Cc1ncnc2ncnn12.
What is the InChIKey of 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine?
The InChIKey is BUVVPUWVZFVWNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5/c1-4-6-2-7-5-8-3-9-10(4)5/h2-3H,1H3.
What are the key properties of 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine?
7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine has a molecular weight of 135.13 g/mol, XLogP of -0.17, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine is sourced from PubChem (CID 70221930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).