5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine

C18H34N2O — CID 64859995

IUPAC5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine
SMILESCCC1CNC(C2CCCCC2)CN1CC1CCOCC1
InChIInChI=1S/C18H34N2O/c1-2-17-12-19-18(16-6-4-3-5-7-16)14-20(17)13-15-8-10-21-11-9-15/h15-19H,2-14H2,1H3
InChIKeySBIZGOGIRMYOIP-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.05
Rot. Bonds4

About 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine

5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine (PubChem CID 64859995) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine.

Molecular Properties

Compound Name5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine
PubChem CID64859995
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine
SMILESCCC1CNC(C2CCCCC2)CN1CC1CCOCC1
InChIInChI=1S/C18H34N2O/c1-2-17-12-19-18(16-6-4-3-5-7-16)14-20(17)13-15-8-10-21-11-9-15/h15-19H,2-14H2,1H3
InChIKeySBIZGOGIRMYOIP-UHFFFAOYSA-N
XLogP3.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine
CID 64861065
5-cyclohexyl-1-(oxolan-3-ylmethyl)-2-propylpiperazine
CID 64860188
2,5-diethyl-1-(oxan-4-ylmethyl)piperazine
CID 64842307
1-(cyclobutylmethyl)-5-cyclohexyl-2-propylpiperazine
CID 65462078
5-cyclohexyl-1-(2-cyclopentylethyl)-2-ethylpiperazine
CID 64935138
5-cyclopropyl-2-ethyl-1-[2-(oxolan-3-yl)ethyl]piperazine
CID 114129860
5-cyclopropyl-1,2-diethylpiperazine
CID 64862405
2-ethyl-5-(2-methylpropyl)-1-(oxan-4-ylmethyl)piperazine
CID 64848728
1-(cyclopentylmethyl)-2,5-diethylpiperazine
CID 64843856
5-cyclopropyl-2-ethyl-1-[(1-propan-2-ylpyrrolidin-3-yl)methyl]piperazine
CID 64946186
5-cyclohexyl-2-ethyl-1-hex-5-ynylpiperazine
CID 106211701
5-cyclopropyl-2-methyl-1-(oxolan-3-ylmethyl)piperazine
CID 64860286

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine?
The IUPAC name of 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine (CID 64859995) is 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine.
What is the SMILES notation for 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine?
The canonical SMILES for 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine is CCC1CNC(C2CCCCC2)CN1CC1CCOCC1.
What is the InChIKey of 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine?
The InChIKey is SBIZGOGIRMYOIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-2-17-12-19-18(16-6-4-3-5-7-16)14-20(17)13-15-8-10-21-11-9-15/h15-19H,2-14H2,1H3.
What are the key properties of 5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine?
5-cyclohexyl-2-ethyl-1-(oxan-4-ylmethyl)piperazine has a molecular weight of 294.48 g/mol, XLogP of 3.05, 4 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-(oxan-4-ylmethyl)piperazine is sourced from PubChem (CID 64859995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).