1-(1-cyclohexylpropyl)piperazin-2-one

C13H24N2O — CID 64566211

IUPAC1-(1-cyclohexylpropyl)piperazin-2-one
SMILESCCC(C1CCCCC1)N1CCNCC1=O
InChIInChI=1S/C13H24N2O/c1-2-12(11-6-4-3-5-7-11)15-9-8-14-10-13(15)16/h11-12,14H,2-10H2,1H3
InChIKeyQTAILPYPCWHCMN-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds3

About 1-(1-cyclohexylpropyl)piperazin-2-one

1-(1-cyclohexylpropyl)piperazin-2-one (PubChem CID 64566211) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(1-cyclohexylpropyl)piperazin-2-one.

Molecular Properties

Compound Name1-(1-cyclohexylpropyl)piperazin-2-one
PubChem CID64566211
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-(1-cyclohexylpropyl)piperazin-2-one
SMILESCCC(C1CCCCC1)N1CCNCC1=O
InChIInChI=1S/C13H24N2O/c1-2-12(11-6-4-3-5-7-11)15-9-8-14-10-13(15)16/h11-12,14H,2-10H2,1H3
InChIKeyQTAILPYPCWHCMN-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylpropyl)piperazin-2-one?
The IUPAC name of 1-(1-cyclohexylpropyl)piperazin-2-one (CID 64566211) is 1-(1-cyclohexylpropyl)piperazin-2-one.
What is the SMILES notation for 1-(1-cyclohexylpropyl)piperazin-2-one?
The canonical SMILES for 1-(1-cyclohexylpropyl)piperazin-2-one is CCC(C1CCCCC1)N1CCNCC1=O.
What is the InChIKey of 1-(1-cyclohexylpropyl)piperazin-2-one?
The InChIKey is QTAILPYPCWHCMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-12(11-6-4-3-5-7-11)15-9-8-14-10-13(15)16/h11-12,14H,2-10H2,1H3.
What are the key properties of 1-(1-cyclohexylpropyl)piperazin-2-one?
1-(1-cyclohexylpropyl)piperazin-2-one has a molecular weight of 224.35 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylpropyl)piperazin-2-one is sourced from PubChem (CID 64566211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).