1-cyclopent-2-en-1-ylpiperazine

C9H16N2 — CID 14839580

IUPAC1-cyclopent-2-en-1-ylpiperazine
SMILESC1=CC(N2CCNCC2)CC1
InChIInChI=1S/C9H16N2/c1-2-4-9(3-1)11-7-5-10-6-8-11/h1,3,9-10H,2,4-8H2
InChIKeyXKDZPYWEVCSREP-UHFFFAOYSA-N
MW152.24 g/mol
LogP0.61
Rot. Bonds1

About 1-cyclopent-2-en-1-ylpiperazine

1-cyclopent-2-en-1-ylpiperazine (PubChem CID 14839580) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-cyclopent-2-en-1-ylpiperazine.

Molecular Properties

Compound Name1-cyclopent-2-en-1-ylpiperazine
PubChem CID14839580
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name1-cyclopent-2-en-1-ylpiperazine
SMILESC1=CC(N2CCNCC2)CC1
InChIInChI=1S/C9H16N2/c1-2-4-9(3-1)11-7-5-10-6-8-11/h1,3,9-10H,2,4-8H2
InChIKeyXKDZPYWEVCSREP-UHFFFAOYSA-N
XLogP0.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 50.61
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-2-en-1-ylpiperazine?
The IUPAC name of 1-cyclopent-2-en-1-ylpiperazine (CID 14839580) is 1-cyclopent-2-en-1-ylpiperazine.
What is the SMILES notation for 1-cyclopent-2-en-1-ylpiperazine?
The canonical SMILES for 1-cyclopent-2-en-1-ylpiperazine is C1=CC(N2CCNCC2)CC1.
What is the InChIKey of 1-cyclopent-2-en-1-ylpiperazine?
The InChIKey is XKDZPYWEVCSREP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-2-4-9(3-1)11-7-5-10-6-8-11/h1,3,9-10H,2,4-8H2.
What are the key properties of 1-cyclopent-2-en-1-ylpiperazine?
1-cyclopent-2-en-1-ylpiperazine has a molecular weight of 152.24 g/mol, XLogP of 0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopent-2-en-1-ylpiperazine is sourced from PubChem (CID 14839580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).