cyclopent-2-en-1-yl(piperazin-1-yl)methanone

C10H16N2O — CID 21183966

IUPACcyclopent-2-en-1-yl(piperazin-1-yl)methanone
SMILESO=C(C1C=CCC1)N1CCNCC1
InChIInChI=1S/C10H16N2O/c13-10(9-3-1-2-4-9)12-7-5-11-6-8-12/h1,3,9,11H,2,4-8H2
InChIKeyFUEQFFCZAGYXHW-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.38
Rot. Bonds1

About cyclopent-2-en-1-yl(piperazin-1-yl)methanone

cyclopent-2-en-1-yl(piperazin-1-yl)methanone (PubChem CID 21183966) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is cyclopent-2-en-1-yl(piperazin-1-yl)methanone.

Molecular Properties

Compound Namecyclopent-2-en-1-yl(piperazin-1-yl)methanone
PubChem CID21183966
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Namecyclopent-2-en-1-yl(piperazin-1-yl)methanone
SMILESO=C(C1C=CCC1)N1CCNCC1
InChIInChI=1S/C10H16N2O/c13-10(9-3-1-2-4-9)12-7-5-11-6-8-12/h1,3,9,11H,2,4-8H2
InChIKeyFUEQFFCZAGYXHW-UHFFFAOYSA-N
XLogP0.38
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cyclopent-2-en-1-yl(piperazin-1-yl)methanone?
The IUPAC name of cyclopent-2-en-1-yl(piperazin-1-yl)methanone (CID 21183966) is cyclopent-2-en-1-yl(piperazin-1-yl)methanone.
What is the SMILES notation for cyclopent-2-en-1-yl(piperazin-1-yl)methanone?
The canonical SMILES for cyclopent-2-en-1-yl(piperazin-1-yl)methanone is O=C(C1C=CCC1)N1CCNCC1.
What is the InChIKey of cyclopent-2-en-1-yl(piperazin-1-yl)methanone?
The InChIKey is FUEQFFCZAGYXHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c13-10(9-3-1-2-4-9)12-7-5-11-6-8-12/h1,3,9,11H,2,4-8H2.
What are the key properties of cyclopent-2-en-1-yl(piperazin-1-yl)methanone?
cyclopent-2-en-1-yl(piperazin-1-yl)methanone has a molecular weight of 180.25 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-2-en-1-yl(piperazin-1-yl)methanone is sourced from PubChem (CID 21183966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).