1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol

C₁₂H₁₉NO — CID 143150891

About 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol

1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol (PubChem CID 143150891) has the molecular formula C₁₂H₁₉NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol.

Molecular Properties

• Compound Name: 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol
• PubChem CID: 143150891
• Molecular Formula: C₁₂H₁₉NO
• Molecular Weight: 193.29 g/mol
• Exact Mass: 193.15
• IUPAC Name: 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol
• SMILES: C=C/C=C(\C=C)CN1CCC(O)CC1
• InChI: InChI=1S/C12H19NO/c1-3-5-11(4-2)10-13-8-6-12(14)7-9-13/h3-5,12,14H,1-2,6-10H2/b11-5+
• InChIKey: NGNZWPVGKUXFKF-VZUCSPMQSA-N
• XLogP: 1.74
• TPSA: 23.47 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 4
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	193.29
LogP ≤ 5	1.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol?

The IUPAC name of 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol (CID 143150891) is 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol.

What is the SMILES notation for 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol?

The canonical SMILES for 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol is C=C/C=C(\C=C)CN1CCC(O)CC1.

What is the InChIKey of 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol?

The InChIKey is NGNZWPVGKUXFKF-VZUCSPMQSA-N. The full InChI is InChI=1S/C12H19NO/c1-3-5-11(4-2)10-13-8-6-12(14)7-9-13/h3-5,12,14H,1-2,6-10H2/b11-5+.

What are the key properties of 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol?

1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol has a molecular weight of 193.29 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(2E)-2-ethenylpenta-2,4-dienyl]piperidin-4-ol is sourced from PubChem (CID 143150891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 143150891 — identifiers, structure, computed properties (public domain)

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