1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine

C13H28N2O — CID 64846765

IUPAC1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
SMILESCCCC1CN(CCOCC)C(CC)CN1
InChIInChI=1S/C13H28N2O/c1-4-7-12-11-15(8-9-16-6-3)13(5-2)10-14-12/h12-14H,4-11H2,1-3H3
InChIKeyXJEVVISITLEQKH-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.88
Rot. Bonds7

About 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine

1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine (PubChem CID 64846765) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine.

Molecular Properties

Compound Name1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
PubChem CID64846765
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
SMILESCCCC1CN(CCOCC)C(CC)CN1
InChIInChI=1S/C13H28N2O/c1-4-7-12-11-15(8-9-16-6-3)13(5-2)10-14-12/h12-14H,4-11H2,1-3H3
InChIKeyXJEVVISITLEQKH-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-ethoxyethyl)-2,5-dipropylpiperazine
CID 64844595
2-ethyl-5-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]piperazine
CID 64845197
1-(2-cyclohexyloxyethyl)-2-ethyl-5-propylpiperazine
CID 64942384
1-[2-(3-methylbutoxy)ethyl]-2-(2-methylpropyl)-5-propylpiperazine
CID 64839963
1-(cyclobutylmethyl)-2-ethyl-5-propylpiperazine
CID 64936155
1-(cyclopentylmethyl)-2-ethyl-5-propylpiperazine
CID 64845195
2-ethyl-1-methyl-5-propylpiperazine
CID 64846947
1-(2-but-3-enoxyethyl)-2,5-diethylpiperazine
CID 106409149
1-(2-butoxyethyl)-2-methyl-5-propylpiperazine
CID 64846186
1-[(E)-but-2-enyl]-2-ethyl-5-propylpiperazine
CID 107897901
2-ethyl-1-(3-methylbut-2-enyl)-5-propylpiperazine
CID 107901441
2-ethyl-5-propyl-1-(2,3,3-trimethylbutyl)piperazine
CID 83146417

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine?
The IUPAC name of 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine (CID 64846765) is 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine.
What is the SMILES notation for 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine?
The canonical SMILES for 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine is CCCC1CN(CCOCC)C(CC)CN1.
What is the InChIKey of 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine?
The InChIKey is XJEVVISITLEQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-7-12-11-15(8-9-16-6-3)13(5-2)10-14-12/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine?
1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine has a molecular weight of 228.38 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine is sourced from PubChem (CID 64846765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).