1-hydroxy-2,6-bis(prop-2-enyl)piperidine

C11H19NO — CID 67644248

IUPAC1-hydroxy-2,6-bis(prop-2-enyl)piperidine
SMILESC=CCC1CCCC(CC=C)N1O
InChIInChI=1S/C11H19NO/c1-3-6-10-8-5-9-11(7-4-2)12(10)13/h3-4,10-11,13H,1-2,5-9H2
InChIKeyCKSAWYHVSWYEDC-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.75
Rot. Bonds4

About 1-hydroxy-2,6-bis(prop-2-enyl)piperidine

1-hydroxy-2,6-bis(prop-2-enyl)piperidine (PubChem CID 67644248) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-hydroxy-2,6-bis(prop-2-enyl)piperidine.

Molecular Properties

Compound Name1-hydroxy-2,6-bis(prop-2-enyl)piperidine
PubChem CID67644248
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name1-hydroxy-2,6-bis(prop-2-enyl)piperidine
SMILESC=CCC1CCCC(CC=C)N1O
InChIInChI=1S/C11H19NO/c1-3-6-10-8-5-9-11(7-4-2)12(10)13/h3-4,10-11,13H,1-2,5-9H2
InChIKeyCKSAWYHVSWYEDC-UHFFFAOYSA-N
XLogP2.75
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.75
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-hydroxy-2,6-bis(prop-2-enyl)piperidine?
The IUPAC name of 1-hydroxy-2,6-bis(prop-2-enyl)piperidine (CID 67644248) is 1-hydroxy-2,6-bis(prop-2-enyl)piperidine.
What is the SMILES notation for 1-hydroxy-2,6-bis(prop-2-enyl)piperidine?
The canonical SMILES for 1-hydroxy-2,6-bis(prop-2-enyl)piperidine is C=CCC1CCCC(CC=C)N1O.
What is the InChIKey of 1-hydroxy-2,6-bis(prop-2-enyl)piperidine?
The InChIKey is CKSAWYHVSWYEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-3-6-10-8-5-9-11(7-4-2)12(10)13/h3-4,10-11,13H,1-2,5-9H2.
What are the key properties of 1-hydroxy-2,6-bis(prop-2-enyl)piperidine?
1-hydroxy-2,6-bis(prop-2-enyl)piperidine has a molecular weight of 181.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2,6-bis(prop-2-enyl)piperidine is sourced from PubChem (CID 67644248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).