2,5-bis(prop-2-enyl)piperidine

C11H19N — CID 66742489

IUPAC2,5-bis(prop-2-enyl)piperidine
SMILESC=CCC1CCC(CC=C)NC1
InChIInChI=1S/C11H19N/c1-3-5-10-7-8-11(6-4-2)12-9-10/h3-4,10-12H,1-2,5-9H2
InChIKeyMSZPZGQSZBRBMN-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.51
Rot. Bonds4

About 2,5-bis(prop-2-enyl)piperidine

2,5-bis(prop-2-enyl)piperidine (PubChem CID 66742489) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 2,5-bis(prop-2-enyl)piperidine.

Molecular Properties

Compound Name2,5-bis(prop-2-enyl)piperidine
PubChem CID66742489
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name2,5-bis(prop-2-enyl)piperidine
SMILESC=CCC1CCC(CC=C)NC1
InChIInChI=1S/C11H19N/c1-3-5-10-7-8-11(6-4-2)12-9-10/h3-4,10-12H,1-2,5-9H2
InChIKeyMSZPZGQSZBRBMN-UHFFFAOYSA-N
XLogP2.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 2,5-bis(prop-2-enyl)piperidine?
The IUPAC name of 2,5-bis(prop-2-enyl)piperidine (CID 66742489) is 2,5-bis(prop-2-enyl)piperidine.
What is the SMILES notation for 2,5-bis(prop-2-enyl)piperidine?
The canonical SMILES for 2,5-bis(prop-2-enyl)piperidine is C=CCC1CCC(CC=C)NC1.
What is the InChIKey of 2,5-bis(prop-2-enyl)piperidine?
The InChIKey is MSZPZGQSZBRBMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-3-5-10-7-8-11(6-4-2)12-9-10/h3-4,10-12H,1-2,5-9H2.
What are the key properties of 2,5-bis(prop-2-enyl)piperidine?
2,5-bis(prop-2-enyl)piperidine has a molecular weight of 165.28 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(prop-2-enyl)piperidine is sourced from PubChem (CID 66742489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).