2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine

C19H32N2 — CID 82926530

IUPAC2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine
SMILESCCC(CC)CN1CC(c2ccccc2)NCC1(C)CC
InChIInChI=1S/C19H32N2/c1-5-16(6-2)13-21-14-18(17-11-9-8-10-12-17)20-15-19(21,4)7-3/h8-12,16,18,20H,5-7,13-15H2,1-4H3
InChIKeyDOFJPIBZMLUVMA-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.24
Rot. Bonds6

About 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine

2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine (PubChem CID 82926530) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine
PubChem CID82926530
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine
SMILESCCC(CC)CN1CC(c2ccccc2)NCC1(C)CC
InChIInChI=1S/C19H32N2/c1-5-16(6-2)13-21-14-18(17-11-9-8-10-12-17)20-15-19(21,4)7-3/h8-12,16,18,20H,5-7,13-15H2,1-4H3
InChIKeyDOFJPIBZMLUVMA-UHFFFAOYSA-N
XLogP4.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine 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-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine?
The IUPAC name of 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine (CID 82926530) is 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine.
What is the SMILES notation for 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine?
The canonical SMILES for 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine is CCC(CC)CN1CC(c2ccccc2)NCC1(C)CC.
What is the InChIKey of 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine?
The InChIKey is DOFJPIBZMLUVMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-16(6-2)13-21-14-18(17-11-9-8-10-12-17)20-15-19(21,4)7-3/h8-12,16,18,20H,5-7,13-15H2,1-4H3.
What are the key properties of 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine?
2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine has a molecular weight of 288.48 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(2-ethylbutyl)-2-methyl-5-phenylpiperazine is sourced from PubChem (CID 82926530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).