1-(2-ethylbutyl)-2-propylpiperazine

C13H28N2 — CID 82923563

IUPAC1-(2-ethylbutyl)-2-propylpiperazine
SMILESCCCC1CNCCN1CC(CC)CC
InChIInChI=1S/C13H28N2/c1-4-7-13-10-14-8-9-15(13)11-12(5-2)6-3/h12-14H,4-11H2,1-3H3
InChIKeyAGGQFTRHVWITDD-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.50
Rot. Bonds6

About 1-(2-ethylbutyl)-2-propylpiperazine

1-(2-ethylbutyl)-2-propylpiperazine (PubChem CID 82923563) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(2-ethylbutyl)-2-propylpiperazine.

Molecular Properties

Compound Name1-(2-ethylbutyl)-2-propylpiperazine
PubChem CID82923563
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(2-ethylbutyl)-2-propylpiperazine
SMILESCCCC1CNCCN1CC(CC)CC
InChIInChI=1S/C13H28N2/c1-4-7-13-10-14-8-9-15(13)11-12(5-2)6-3/h12-14H,4-11H2,1-3H3
InChIKeyAGGQFTRHVWITDD-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-ethylbutyl)-2-propylpiperazine 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 1-(2-ethylbutyl)-2-propylpiperazine?
The IUPAC name of 1-(2-ethylbutyl)-2-propylpiperazine (CID 82923563) is 1-(2-ethylbutyl)-2-propylpiperazine.
What is the SMILES notation for 1-(2-ethylbutyl)-2-propylpiperazine?
The canonical SMILES for 1-(2-ethylbutyl)-2-propylpiperazine is CCCC1CNCCN1CC(CC)CC.
What is the InChIKey of 1-(2-ethylbutyl)-2-propylpiperazine?
The InChIKey is AGGQFTRHVWITDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-7-13-10-14-8-9-15(13)11-12(5-2)6-3/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-(2-ethylbutyl)-2-propylpiperazine?
1-(2-ethylbutyl)-2-propylpiperazine has a molecular weight of 212.38 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylbutyl)-2-propylpiperazine is sourced from PubChem (CID 82923563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).