4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine

C13H23N — CID 89122682

IUPAC4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine
SMILESC/C=C/CCC1(/C=C/C)CCNCC1
InChIInChI=1S/C13H23N/c1-3-5-6-8-13(7-4-2)9-11-14-12-10-13/h3-5,7,14H,6,8-12H2,1-2H3/b5-3+,7-4+
InChIKeyHYCSNYBKKTWEQO-HJIKTHEYSA-N
MW193.33 g/mol
LogP3.29
Rot. Bonds4

About 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine

4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine (PubChem CID 89122682) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine.

Molecular Properties

Compound Name4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine
PubChem CID89122682
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine
SMILESC/C=C/CCC1(/C=C/C)CCNCC1
InChIInChI=1S/C13H23N/c1-3-5-6-8-13(7-4-2)9-11-14-12-10-13/h3-5,7,14H,6,8-12H2,1-2H3/b5-3+,7-4+
InChIKeyHYCSNYBKKTWEQO-HJIKTHEYSA-N
XLogP3.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.29
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 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine?
The IUPAC name of 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine (CID 89122682) is 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine.
What is the SMILES notation for 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine?
The canonical SMILES for 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine is C/C=C/CCC1(/C=C/C)CCNCC1.
What is the InChIKey of 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine?
The InChIKey is HYCSNYBKKTWEQO-HJIKTHEYSA-N. The full InChI is InChI=1S/C13H23N/c1-3-5-6-8-13(7-4-2)9-11-14-12-10-13/h3-5,7,14H,6,8-12H2,1-2H3/b5-3+,7-4+.
What are the key properties of 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine?
4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine has a molecular weight of 193.33 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]piperidine is sourced from PubChem (CID 89122682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).