1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine

C17H27NO — CID 173116877

IUPAC1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine
SMILESC=CCC1(CC=C)CCCN(O)C1(CC=C)CC=C
InChIInChI=1S/C17H27NO/c1-5-10-16(11-6-2)14-9-15-18(19)17(16,12-7-3)13-8-4/h5-8,19H,1-4,9-15H2
InChIKeyLFFAAPQHVVMCDD-UHFFFAOYSA-N
MW261.41 g/mol
LogP4.50
Rot. Bonds8

About 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine

1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine (PubChem CID 173116877) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine.

Molecular Properties

Compound Name1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine
PubChem CID173116877
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine
SMILESC=CCC1(CC=C)CCCN(O)C1(CC=C)CC=C
InChIInChI=1S/C17H27NO/c1-5-10-16(11-6-2)14-9-15-18(19)17(16,12-7-3)13-8-4/h5-8,19H,1-4,9-15H2
InChIKeyLFFAAPQHVVMCDD-UHFFFAOYSA-N
XLogP4.50
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 54.50
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-2,2,3,3-tetrakis(prop-2-enyl)piperidine?
The IUPAC name of 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine (CID 173116877) is 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine.
What is the SMILES notation for 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine?
The canonical SMILES for 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine is C=CCC1(CC=C)CCCN(O)C1(CC=C)CC=C.
What is the InChIKey of 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine?
The InChIKey is LFFAAPQHVVMCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-5-10-16(11-6-2)14-9-15-18(19)17(16,12-7-3)13-8-4/h5-8,19H,1-4,9-15H2.
What are the key properties of 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine?
1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine has a molecular weight of 261.41 g/mol, XLogP of 4.50, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2,2,3,3-tetrakis(prop-2-enyl)piperidine is sourced from PubChem (CID 173116877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).