2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine

C18H36N2O — CID 64860257

IUPAC2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine
SMILESCCOCCN1CC(CC)(CC)NCC1C1CCCCC1
InChIInChI=1S/C18H36N2O/c1-4-18(5-2)15-20(12-13-21-6-3)17(14-19-18)16-10-8-7-9-11-16/h16-17,19H,4-15H2,1-3H3
InChIKeyRTJIPFVJRFIEDS-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.44
Rot. Bonds7

About 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine

2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine (PubChem CID 64860257) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine.

Molecular Properties

Compound Name2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine
PubChem CID64860257
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine
SMILESCCOCCN1CC(CC)(CC)NCC1C1CCCCC1
InChIInChI=1S/C18H36N2O/c1-4-18(5-2)15-20(12-13-21-6-3)17(14-19-18)16-10-8-7-9-11-16/h16-17,19H,4-15H2,1-3H3
InChIKeyRTJIPFVJRFIEDS-UHFFFAOYSA-N
XLogP3.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.44
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

2-cyclohexyl-1-(cyclopropylmethyl)-5,5-diethylpiperazine
CID 64860640
2-cyclopropyl-1-(3-ethoxypropyl)-5-ethyl-5-methylpiperazine
CID 65177810
2-cyclopropyl-5,5-diethyl-1-(2-methylsulfanylethyl)piperazine
CID 113474584
2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine
CID 64861980
3-cyclopropyl-4-(2-propoxyethyl)-1,4-diazaspiro[5.5]undecane
CID 106458748
2-cyclohexyl-1-(3-ethoxypropyl)-5-methylpiperazine
CID 65177857
2-cyclopropyl-5,5-diethyl-1-(2-propylsulfonylethyl)piperazine
CID 106733248
2-cyclohexyl-1-(2-fluoroethyl)-5,5-dimethylpiperazine
CID 80698025
2-cyclohexyl-1-hexyl-5,5-dimethylpiperazine
CID 64840300
2-cyclohexyl-5-cyclopropyl-1-(3-methoxypropyl)-5-methylpiperazine
CID 64877905
2-cyclopropyl-5,5-diethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine
CID 103016627
2-cyclopropyl-5,5-diethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64861983

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine?
The IUPAC name of 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine (CID 64860257) is 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine.
What is the SMILES notation for 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine?
The canonical SMILES for 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine is CCOCCN1CC(CC)(CC)NCC1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine?
The InChIKey is RTJIPFVJRFIEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-18(5-2)15-20(12-13-21-6-3)17(14-19-18)16-10-8-7-9-11-16/h16-17,19H,4-15H2,1-3H3.
What are the key properties of 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine?
2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine has a molecular weight of 296.50 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine is sourced from PubChem (CID 64860257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).