2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole

C6H8N4 — CID 10510908

IUPAC2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCc1nc2ccnn2[nH]1
InChIInChI=1S/C6H8N4/c1-2-5-8-6-3-4-7-10(6)9-5/h3-4H,2H2,1H3,(H,8,9)
InChIKeyGYMLMGZEWCBQSE-UHFFFAOYSA-N
MW136.16 g/mol
LogP0.62
Rot. Bonds1

About 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole

2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole (PubChem CID 10510908) has the molecular formula C6H8N4 and a molecular weight of 136.16 g/mol. Its IUPAC name is 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole.

Molecular Properties

Compound Name2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
PubChem CID10510908
Molecular FormulaC6H8N4
Molecular Weight136.16 g/mol
Exact Mass136.07
IUPAC Name2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCc1nc2ccnn2[nH]1
InChIInChI=1S/C6H8N4/c1-2-5-8-6-3-4-7-10(6)9-5/h3-4H,2H2,1H3,(H,8,9)
InChIKeyGYMLMGZEWCBQSE-UHFFFAOYSA-N
XLogP0.62
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.16
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
The IUPAC name of 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole (CID 10510908) is 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole.
What is the SMILES notation for 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
The canonical SMILES for 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole is CCc1nc2ccnn2[nH]1.
What is the InChIKey of 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
The InChIKey is GYMLMGZEWCBQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4/c1-2-5-8-6-3-4-7-10(6)9-5/h3-4H,2H2,1H3,(H,8,9).
What are the key properties of 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole?
2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole has a molecular weight of 136.16 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3H-pyrazolo[1,5-b][1,2,4]triazole is sourced from PubChem (CID 10510908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).