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

C11H18N4 — CID 10679803

IUPAC2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCCc1[nH]n2nc(CC)nc2c1CC
InChIInChI=1S/C11H18N4/c1-4-7-9-8(5-2)11-12-10(6-3)14-15(11)13-9/h13H,4-7H2,1-3H3
InChIKeyDCMXLBKQJXMMQZ-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.13
Rot. Bonds4

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

2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole (PubChem CID 10679803) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole.

Molecular Properties

Compound Name2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole
PubChem CID10679803
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole
SMILESCCCc1[nH]n2nc(CC)nc2c1CC
InChIInChI=1S/C11H18N4/c1-4-7-9-8(5-2)11-12-10(6-3)14-15(11)13-9/h13H,4-7H2,1-3H3
InChIKeyDCMXLBKQJXMMQZ-UHFFFAOYSA-N
XLogP2.13
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
The IUPAC name of 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole (CID 10679803) is 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole.
What is the SMILES notation for 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
The canonical SMILES for 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole is CCCc1[nH]n2nc(CC)nc2c1CC.
What is the InChIKey of 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
The InChIKey is DCMXLBKQJXMMQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-4-7-9-8(5-2)11-12-10(6-3)14-15(11)13-9/h13H,4-7H2,1-3H3.
What are the key properties of 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole?
2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole has a molecular weight of 206.29 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-diethyl-6-propyl-5H-pyrazolo[1,5-b][1,2,4]triazole is sourced from PubChem (CID 10679803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).