2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine

C7H8N4 — CID 13000580

IUPAC2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCc1nc(C)n2nccc2n1
InChIInChI=1S/C7H8N4/c1-5-9-6(2)11-7(10-5)3-4-8-11/h3-4H,1-2H3
InChIKeyISOJZBVLLFJSLI-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.74
Rot. Bonds

About 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine

2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine (PubChem CID 13000580) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine.

Molecular Properties

Compound Name2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
PubChem CID13000580
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCc1nc(C)n2nccc2n1
InChIInChI=1S/C7H8N4/c1-5-9-6(2)11-7(10-5)3-4-8-11/h3-4H,1-2H3
InChIKeyISOJZBVLLFJSLI-UHFFFAOYSA-N
XLogP0.74
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
The IUPAC name of 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine (CID 13000580) is 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine.
What is the SMILES notation for 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
The canonical SMILES for 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine is Cc1nc(C)n2nccc2n1.
What is the InChIKey of 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
The InChIKey is ISOJZBVLLFJSLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-5-9-6(2)11-7(10-5)3-4-8-11/h3-4H,1-2H3.
What are the key properties of 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine?
2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine has a molecular weight of 148.17 g/mol, XLogP of 0.74, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine is sourced from PubChem (CID 13000580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).