4-ethylpyrazolo[1,5-a][1,3,5]triazine

C7H8N4 — CID 154468252

IUPAC4-ethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCCc1ncnc2ccnn12
InChIInChI=1S/C7H8N4/c1-2-6-8-5-9-7-3-4-10-11(6)7/h3-5H,2H2,1H3
InChIKeyNMIDRAGYBUVFBU-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.69
Rot. Bonds1

About 4-ethylpyrazolo[1,5-a][1,3,5]triazine

4-ethylpyrazolo[1,5-a][1,3,5]triazine (PubChem CID 154468252) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 4-ethylpyrazolo[1,5-a][1,3,5]triazine.

Molecular Properties

Compound Name4-ethylpyrazolo[1,5-a][1,3,5]triazine
PubChem CID154468252
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name4-ethylpyrazolo[1,5-a][1,3,5]triazine
SMILESCCc1ncnc2ccnn12
InChIInChI=1S/C7H8N4/c1-2-6-8-5-9-7-3-4-10-11(6)7/h3-5H,2H2,1H3
InChIKeyNMIDRAGYBUVFBU-UHFFFAOYSA-N
XLogP0.69
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethylpyrazolo[1,5-a][1,3,5]triazine?
The IUPAC name of 4-ethylpyrazolo[1,5-a][1,3,5]triazine (CID 154468252) is 4-ethylpyrazolo[1,5-a][1,3,5]triazine.
What is the SMILES notation for 4-ethylpyrazolo[1,5-a][1,3,5]triazine?
The canonical SMILES for 4-ethylpyrazolo[1,5-a][1,3,5]triazine is CCc1ncnc2ccnn12.
What is the InChIKey of 4-ethylpyrazolo[1,5-a][1,3,5]triazine?
The InChIKey is NMIDRAGYBUVFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-2-6-8-5-9-7-3-4-10-11(6)7/h3-5H,2H2,1H3.
What are the key properties of 4-ethylpyrazolo[1,5-a][1,3,5]triazine?
4-ethylpyrazolo[1,5-a][1,3,5]triazine has a molecular weight of 148.17 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylpyrazolo[1,5-a][1,3,5]triazine is sourced from PubChem (CID 154468252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).