1-(cyclopent-3-en-1-ylmethyl)piperazine

C10H18N2 — CID 65353471

IUPAC1-(cyclopent-3-en-1-ylmethyl)piperazine
SMILESC1=CCC(CN2CCNCC2)C1
InChIInChI=1S/C10H18N2/c1-2-4-10(3-1)9-12-7-5-11-6-8-12/h1-2,10-11H,3-9H2
InChIKeyOUESXOKPXMTWQA-UHFFFAOYSA-N
MW166.27 g/mol
LogP0.86
Rot. Bonds2

About 1-(cyclopent-3-en-1-ylmethyl)piperazine

1-(cyclopent-3-en-1-ylmethyl)piperazine (PubChem CID 65353471) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-(cyclopent-3-en-1-ylmethyl)piperazine.

Molecular Properties

Compound Name1-(cyclopent-3-en-1-ylmethyl)piperazine
PubChem CID65353471
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-(cyclopent-3-en-1-ylmethyl)piperazine
SMILESC1=CCC(CN2CCNCC2)C1
InChIInChI=1S/C10H18N2/c1-2-4-10(3-1)9-12-7-5-11-6-8-12/h1-2,10-11H,3-9H2
InChIKeyOUESXOKPXMTWQA-UHFFFAOYSA-N
XLogP0.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 50.86
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 1-(cyclopent-3-en-1-ylmethyl)piperazine?
The IUPAC name of 1-(cyclopent-3-en-1-ylmethyl)piperazine (CID 65353471) is 1-(cyclopent-3-en-1-ylmethyl)piperazine.
What is the SMILES notation for 1-(cyclopent-3-en-1-ylmethyl)piperazine?
The canonical SMILES for 1-(cyclopent-3-en-1-ylmethyl)piperazine is C1=CCC(CN2CCNCC2)C1.
What is the InChIKey of 1-(cyclopent-3-en-1-ylmethyl)piperazine?
The InChIKey is OUESXOKPXMTWQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-4-10(3-1)9-12-7-5-11-6-8-12/h1-2,10-11H,3-9H2.
What are the key properties of 1-(cyclopent-3-en-1-ylmethyl)piperazine?
1-(cyclopent-3-en-1-ylmethyl)piperazine has a molecular weight of 166.27 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopent-3-en-1-ylmethyl)piperazine is sourced from PubChem (CID 65353471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).