1-(2-cyclohexylethyl)piperidin-4-one

C13H23NO — CID 11413149

IUPAC1-(2-cyclohexylethyl)piperidin-4-one
SMILESO=C1CCN(CCC2CCCCC2)CC1
InChIInChI=1S/C13H23NO/c15-13-7-10-14(11-8-13)9-6-12-4-2-1-3-5-12/h12H,1-11H2
InChIKeyLGMLSVSVPJSHHD-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.62
Rot. Bonds3

About 1-(2-cyclohexylethyl)piperidin-4-one

1-(2-cyclohexylethyl)piperidin-4-one (PubChem CID 11413149) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 1-(2-cyclohexylethyl)piperidin-4-one.

Molecular Properties

Compound Name1-(2-cyclohexylethyl)piperidin-4-one
PubChem CID11413149
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name1-(2-cyclohexylethyl)piperidin-4-one
SMILESO=C1CCN(CCC2CCCCC2)CC1
InChIInChI=1S/C13H23NO/c15-13-7-10-14(11-8-13)9-6-12-4-2-1-3-5-12/h12H,1-11H2
InChIKeyLGMLSVSVPJSHHD-UHFFFAOYSA-N
XLogP2.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylethyl)piperidin-4-one?
The IUPAC name of 1-(2-cyclohexylethyl)piperidin-4-one (CID 11413149) is 1-(2-cyclohexylethyl)piperidin-4-one.
What is the SMILES notation for 1-(2-cyclohexylethyl)piperidin-4-one?
The canonical SMILES for 1-(2-cyclohexylethyl)piperidin-4-one is O=C1CCN(CCC2CCCCC2)CC1.
What is the InChIKey of 1-(2-cyclohexylethyl)piperidin-4-one?
The InChIKey is LGMLSVSVPJSHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c15-13-7-10-14(11-8-13)9-6-12-4-2-1-3-5-12/h12H,1-11H2.
What are the key properties of 1-(2-cyclohexylethyl)piperidin-4-one?
1-(2-cyclohexylethyl)piperidin-4-one has a molecular weight of 209.33 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylethyl)piperidin-4-one is sourced from PubChem (CID 11413149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).