3-[(Z)-non-6-enyl]piperidine-2,6-dione

C14H23NO2 — CID 67735392

IUPAC3-[(Z)-non-6-enyl]piperidine-2,6-dione
SMILESCC/C=C\CCCCCC1CCC(=O)NC1=O
InChIInChI=1S/C14H23NO2/c1-2-3-4-5-6-7-8-9-12-10-11-13(16)15-14(12)17/h3-4,12H,2,5-11H2,1H3,(H,15,16,17)/b4-3-
InChIKeyQJCAAGPVZGLWPW-ARJAWSKDSA-N
MW237.34 g/mol
LogP2.96
Rot. Bonds7

About 3-[(Z)-non-6-enyl]piperidine-2,6-dione

3-[(Z)-non-6-enyl]piperidine-2,6-dione (PubChem CID 67735392) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 3-[(Z)-non-6-enyl]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[(Z)-non-6-enyl]piperidine-2,6-dione
PubChem CID67735392
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name3-[(Z)-non-6-enyl]piperidine-2,6-dione
SMILESCC/C=C\CCCCCC1CCC(=O)NC1=O
InChIInChI=1S/C14H23NO2/c1-2-3-4-5-6-7-8-9-12-10-11-13(16)15-14(12)17/h3-4,12H,2,5-11H2,1H3,(H,15,16,17)/b4-3-
InChIKeyQJCAAGPVZGLWPW-ARJAWSKDSA-N
XLogP2.96
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-non-6-enyl]piperidine-2,6-dione?
The IUPAC name of 3-[(Z)-non-6-enyl]piperidine-2,6-dione (CID 67735392) is 3-[(Z)-non-6-enyl]piperidine-2,6-dione.
What is the SMILES notation for 3-[(Z)-non-6-enyl]piperidine-2,6-dione?
The canonical SMILES for 3-[(Z)-non-6-enyl]piperidine-2,6-dione is CC/C=C\CCCCCC1CCC(=O)NC1=O.
What is the InChIKey of 3-[(Z)-non-6-enyl]piperidine-2,6-dione?
The InChIKey is QJCAAGPVZGLWPW-ARJAWSKDSA-N. The full InChI is InChI=1S/C14H23NO2/c1-2-3-4-5-6-7-8-9-12-10-11-13(16)15-14(12)17/h3-4,12H,2,5-11H2,1H3,(H,15,16,17)/b4-3-.
What are the key properties of 3-[(Z)-non-6-enyl]piperidine-2,6-dione?
3-[(Z)-non-6-enyl]piperidine-2,6-dione has a molecular weight of 237.34 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-non-6-enyl]piperidine-2,6-dione is sourced from PubChem (CID 67735392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).