5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine

C18H30N2O — CID 64938160

IUPAC5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine
SMILESCCOCC(C)N1CC(Cc2ccccc2)NCC1CC
InChIInChI=1S/C18H30N2O/c1-4-18-12-19-17(11-16-9-7-6-8-10-16)13-20(18)15(3)14-21-5-2/h6-10,15,17-19H,4-5,11-14H2,1-3H3
InChIKeyORJXCWVMSMVFFC-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.71
Rot. Bonds7

About 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine

5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine (PubChem CID 64938160) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine.

Molecular Properties

Compound Name5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine
PubChem CID64938160
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine
SMILESCCOCC(C)N1CC(Cc2ccccc2)NCC1CC
InChIInChI=1S/C18H30N2O/c1-4-18-12-19-17(11-16-9-7-6-8-10-16)13-20(18)15(3)14-21-5-2/h6-10,15,17-19H,4-5,11-14H2,1-3H3
InChIKeyORJXCWVMSMVFFC-UHFFFAOYSA-N
XLogP2.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine with MolForge

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

Launch Full Analysis

Related Compounds

5-benzyl-1-(1-cyclopropylethyl)-2-ethylpiperazine
CID 64936340
5-benzyl-2-ethyl-1-(2-methylbutyl)piperazine
CID 64849551
5-benzyl-1-tert-butyl-2-ethylpiperazine
CID 64952265
2-ethyl-1-(1-phenylpropan-2-yl)-5-propan-2-ylpiperazine
CID 64937812
5-benzyl-2-ethyl-1-(2-ethylbutyl)piperazine
CID 82926510
5-benzyl-2-methyl-1-pentan-3-ylpiperazine
CID 64954473
5-benzyl-1-(3,3-dimethylbutan-2-yl)-2-methylpiperazine
CID 104830183
5-benzyl-2-ethyl-1-(2-methylsulfanylethyl)piperazine
CID 64936280
2-ethyl-1-(1-methoxypropan-2-yl)-5-propylpiperazine
CID 64932571
2-benzyl-5-ethyl-1-(2-methylpropyl)piperazine
CID 64842935
2-ethyl-1-[1-(4-fluorophenyl)propan-2-yl]-5-propylpiperazine
CID 64940976
2-benzyl-5-ethyl-1-methylpiperazine
CID 64843712

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine?
The IUPAC name of 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine (CID 64938160) is 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine.
What is the SMILES notation for 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine?
The canonical SMILES for 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine is CCOCC(C)N1CC(Cc2ccccc2)NCC1CC.
What is the InChIKey of 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine?
The InChIKey is ORJXCWVMSMVFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-18-12-19-17(11-16-9-7-6-8-10-16)13-20(18)15(3)14-21-5-2/h6-10,15,17-19H,4-5,11-14H2,1-3H3.
What are the key properties of 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine?
5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine has a molecular weight of 290.45 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-1-(1-ethoxypropan-2-yl)-2-ethylpiperazine is sourced from PubChem (CID 64938160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).