2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine

C16H34N2 — CID 83146417

IUPAC2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine
SMILESCCCC1CN(CC(C)C(C)(C)C)C(CC)CN1
InChIInChI=1S/C16H34N2/c1-7-9-14-12-18(15(8-2)10-17-14)11-13(3)16(4,5)6/h13-15,17H,7-12H2,1-6H3
InChIKeyUKTKDSQPAQEKDF-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds5

About 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine

2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine (PubChem CID 83146417) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine.

Molecular Properties

Compound Name2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine
PubChem CID83146417
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine
SMILESCCCC1CN(CC(C)C(C)(C)C)C(CC)CN1
InChIInChI=1S/C16H34N2/c1-7-9-14-12-18(15(8-2)10-17-14)11-13(3)16(4,5)6/h13-15,17H,7-12H2,1-6H3
InChIKeyUKTKDSQPAQEKDF-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-(2-ethylhexyl)-5-propylpiperazine
CID 64846777
2-ethyl-1-(2-phenylpropyl)-5-propylpiperazine
CID 104592373
5-ethyl-1-(2-methylpropyl)-2-propylpiperazine
CID 64842892
1-(cyclobutylmethyl)-2-ethyl-5-propylpiperazine
CID 64936155
1-[(E)-but-2-enyl]-2-ethyl-5-propylpiperazine
CID 107897901
5-tert-butyl-1-(2-methylpropyl)-2-propylpiperazine
CID 64841242
1-(2,3-dimethylbutyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 64941869
2-ethyl-1-(3-methylbut-2-enyl)-5-propylpiperazine
CID 107901441
2-tert-butyl-1-(2-methylpropyl)-5-propylpiperazine
CID 64839180
1-(cyclopentylmethyl)-2-ethyl-5-propylpiperazine
CID 64845195
2-ethyl-1-methyl-5-propylpiperazine
CID 64846947
1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
CID 64846765

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine?
The IUPAC name of 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine (CID 83146417) is 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine.
What is the SMILES notation for 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine?
The canonical SMILES for 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine is CCCC1CN(CC(C)C(C)(C)C)C(CC)CN1.
What is the InChIKey of 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine?
The InChIKey is UKTKDSQPAQEKDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-7-9-14-12-18(15(8-2)10-17-14)11-13(3)16(4,5)6/h13-15,17H,7-12H2,1-6H3.
What are the key properties of 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine?
2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine is sourced from PubChem (CID 83146417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).