1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol

C₁₄H₂₅NO — CID 157039300

About 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol

1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol (PubChem CID 157039300) has the molecular formula C₁₄H₂₅NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol.

Molecular Properties

• Compound Name: 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol
• PubChem CID: 157039300
• Molecular Formula: C₁₄H₂₅NO
• Molecular Weight: 223.36 g/mol
• Exact Mass: 223.19
• IUPAC Name: 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol
• SMILES: C=CC1CCC(CN2CCC(O)CC2)CC1
• InChI: InChI=1S/C14H25NO/c1-2-12-3-5-13(6-4-12)11-15-9-7-14(16)8-10-15/h2,12-14,16H,1,3-11H2
• InChIKey: JSSCFUOSEGNRIL-UHFFFAOYSA-N
• XLogP: 2.44
• TPSA: 23.47 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	223.36
LogP ≤ 5	2.44
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol?

The IUPAC name of 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol (CID 157039300) is 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol.

What is the SMILES notation for 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol?

The canonical SMILES for 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol is C=CC1CCC(CN2CCC(O)CC2)CC1.

What is the InChIKey of 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol?

The InChIKey is JSSCFUOSEGNRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-12-3-5-13(6-4-12)11-15-9-7-14(16)8-10-15/h2,12-14,16H,1,3-11H2.

What are the key properties of 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol?

1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol has a molecular weight of 223.36 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(4-ethenylcyclohexyl)methyl]piperidin-4-ol is sourced from PubChem (CID 157039300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 157039300 — identifiers, structure, computed properties (public domain)

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