5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine

C17H34N2O — CID 64842914

IUPAC5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine
SMILESCCC1CN(C2CCCC(OC)C2)C(CC(C)C)CN1
InChIInChI=1S/C17H34N2O/c1-5-14-12-19(16(11-18-14)9-13(2)3)15-7-6-8-17(10-15)20-4/h13-18H,5-12H2,1-4H3
InChIKeyCMRPIRUTYPMFCU-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.04
Rot. Bonds5

About 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine

5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine (PubChem CID 64842914) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine
PubChem CID64842914
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine
SMILESCCC1CN(C2CCCC(OC)C2)C(CC(C)C)CN1
InChIInChI=1S/C17H34N2O/c1-5-14-12-19(16(11-18-14)9-13(2)3)15-7-6-8-17(10-15)20-4/h13-18H,5-12H2,1-4H3
InChIKeyCMRPIRUTYPMFCU-UHFFFAOYSA-N
XLogP3.04
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxycyclohexyl)-2-methyl-5-propylpiperazine
CID 64846386
2,5-diethyl-1-(3-methylcyclohexyl)piperazine
CID 64934041
1-cyclooctyl-2-ethyl-5-(2-methylpropyl)piperazine
CID 64931371
1-(3-methoxycyclohexyl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 64879586
2,5-diethyl-1-(2-methoxycyclopentyl)piperazine
CID 64946212
1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
CID 82936537
1-cyclohexyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine
CID 79014864
2,5-diethyl-1-(1-propan-2-ylpiperidin-4-yl)piperazine
CID 64977779
1-cycloheptyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
CID 82936451
1-[1-(3-methoxycyclohexyl)piperidin-2-yl]propan-2-ol
CID 114338065
1-(3-methoxycyclohexyl)-3,7-dimethyl-1,4-diazepane
CID 64871751
2-tert-butyl-1-(3-methoxycyclohexyl)-5-methylpiperazine
CID 64844591

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine?
The IUPAC name of 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine (CID 64842914) is 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine.
What is the SMILES notation for 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine?
The canonical SMILES for 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine is CCC1CN(C2CCCC(OC)C2)C(CC(C)C)CN1.
What is the InChIKey of 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine?
The InChIKey is CMRPIRUTYPMFCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-5-14-12-19(16(11-18-14)9-13(2)3)15-7-6-8-17(10-15)20-4/h13-18H,5-12H2,1-4H3.
What are the key properties of 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine?
5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine has a molecular weight of 282.47 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(3-methoxycyclohexyl)-2-(2-methylpropyl)piperazine is sourced from PubChem (CID 64842914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).