2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole

C10H16N4 — CID 10631608

IUPAC2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCc1nc2c(CC)c(CC)[nH]n2n1
InChIInChI=1S/C10H16N4/c1-4-7-8(5-2)12-14-10(7)11-9(6-3)13-14/h12H,4-6H2,1-3H3
InChIKeyUSLMYELJHNDHRW-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.74
Rot. Bonds3

About 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole

2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole (PubChem CID 10631608) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole.

Molecular Properties

Compound Name2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole
PubChem CID10631608
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCc1nc2c(CC)c(CC)[nH]n2n1
InChIInChI=1S/C10H16N4/c1-4-7-8(5-2)12-14-10(7)11-9(6-3)13-14/h12H,4-6H2,1-3H3
InChIKeyUSLMYELJHNDHRW-UHFFFAOYSA-N
XLogP1.74
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
The IUPAC name of 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole (CID 10631608) is 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole.
What is the SMILES notation for 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
The canonical SMILES for 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole is CCc1nc2c(CC)c(CC)[nH]n2n1.
What is the InChIKey of 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
The InChIKey is USLMYELJHNDHRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-4-7-8(5-2)12-14-10(7)11-9(6-3)13-14/h12H,4-6H2,1-3H3.
What are the key properties of 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole has a molecular weight of 192.27 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,7-triethyl-5H-pyrazolo[1,5-b][1,2,4]triazole is sourced from PubChem (CID 10631608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).