4-piperidin-2-ylcyclohexan-1-one

C11H19NO — CID 83262290

IUPAC4-piperidin-2-ylcyclohexan-1-one
SMILESO=C1CCC(C2CCCCN2)CC1
InChIInChI=1S/C11H19NO/c13-10-6-4-9(5-7-10)11-3-1-2-8-12-11/h9,11-12H,1-8H2
InChIKeyKYCOWDDMNCGZGC-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.89
Rot. Bonds1

About 4-piperidin-2-ylcyclohexan-1-one

4-piperidin-2-ylcyclohexan-1-one (PubChem CID 83262290) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 4-piperidin-2-ylcyclohexan-1-one.

Molecular Properties

Compound Name4-piperidin-2-ylcyclohexan-1-one
PubChem CID83262290
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name4-piperidin-2-ylcyclohexan-1-one
SMILESO=C1CCC(C2CCCCN2)CC1
InChIInChI=1S/C11H19NO/c13-10-6-4-9(5-7-10)11-3-1-2-8-12-11/h9,11-12H,1-8H2
InChIKeyKYCOWDDMNCGZGC-UHFFFAOYSA-N
XLogP1.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-piperidin-2-ylcyclohexan-1-one?
The IUPAC name of 4-piperidin-2-ylcyclohexan-1-one (CID 83262290) is 4-piperidin-2-ylcyclohexan-1-one.
What is the SMILES notation for 4-piperidin-2-ylcyclohexan-1-one?
The canonical SMILES for 4-piperidin-2-ylcyclohexan-1-one is O=C1CCC(C2CCCCN2)CC1.
What is the InChIKey of 4-piperidin-2-ylcyclohexan-1-one?
The InChIKey is KYCOWDDMNCGZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c13-10-6-4-9(5-7-10)11-3-1-2-8-12-11/h9,11-12H,1-8H2.
What are the key properties of 4-piperidin-2-ylcyclohexan-1-one?
4-piperidin-2-ylcyclohexan-1-one has a molecular weight of 181.28 g/mol, XLogP of 1.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-2-ylcyclohexan-1-one is sourced from PubChem (CID 83262290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).