2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine

C8H10N4 — CID 18721915

IUPAC2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCc1ncn2nc(C)c(C)c2n1
InChIInChI=1S/C8H10N4/c1-5-6(2)11-12-4-9-7(3)10-8(5)12/h4H,1-3H3
InChIKeyXIDUOERCRPOIOE-UHFFFAOYSA-N
MW162.20 g/mol
LogP1.05
Rot. Bonds

About 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine

2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine (PubChem CID 18721915) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine.

Molecular Properties

Compound Name2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine
PubChem CID18721915
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCc1ncn2nc(C)c(C)c2n1
InChIInChI=1S/C8H10N4/c1-5-6(2)11-12-4-9-7(3)10-8(5)12/h4H,1-3H3
InChIKeyXIDUOERCRPOIOE-UHFFFAOYSA-N
XLogP1.05
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine?
The IUPAC name of 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine (CID 18721915) is 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine.
What is the SMILES notation for 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine?
The canonical SMILES for 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine is Cc1ncn2nc(C)c(C)c2n1.
What is the InChIKey of 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine?
The InChIKey is XIDUOERCRPOIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-5-6(2)11-12-4-9-7(3)10-8(5)12/h4H,1-3H3.
What are the key properties of 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine?
2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine has a molecular weight of 162.20 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7,8-trimethylpyrazolo[1,5-a][1,3,5]triazine is sourced from PubChem (CID 18721915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).