5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine

C17H32N2O — CID 82736117

IUPAC5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine
SMILESCCC1CNC(C2CCCCC2)CN1C1CCOC1C
InChIInChI=1S/C17H32N2O/c1-3-15-11-18-16(14-7-5-4-6-8-14)12-19(15)17-9-10-20-13(17)2/h13-18H,3-12H2,1-2H3
InChIKeyOGRUARZZVIMQRV-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.80
Rot. Bonds3

About 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine

5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine (PubChem CID 82736117) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine.

Molecular Properties

Compound Name5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine
PubChem CID82736117
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine
SMILESCCC1CNC(C2CCCCC2)CN1C1CCOC1C
InChIInChI=1S/C17H32N2O/c1-3-15-11-18-16(14-7-5-4-6-8-14)12-19(15)17-9-10-20-13(17)2/h13-18H,3-12H2,1-2H3
InChIKeyOGRUARZZVIMQRV-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine?
The IUPAC name of 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine (CID 82736117) is 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine.
What is the SMILES notation for 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine?
The canonical SMILES for 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine is CCC1CNC(C2CCCCC2)CN1C1CCOC1C.
What is the InChIKey of 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine?
The InChIKey is OGRUARZZVIMQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-3-15-11-18-16(14-7-5-4-6-8-14)12-19(15)17-9-10-20-13(17)2/h13-18H,3-12H2,1-2H3.
What are the key properties of 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine?
5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine has a molecular weight of 280.46 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine is sourced from PubChem (CID 82736117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).