1,3,3-triethylpiperidine-2,6-dione

C11H19NO2 — CID 3028446

IUPAC1,3,3-triethylpiperidine-2,6-dione
SMILESCCN1C(=O)CCC(CC)(CC)C1=O
InChIInChI=1S/C11H19NO2/c1-4-11(5-2)8-7-9(13)12(6-3)10(11)14/h4-8H2,1-3H3
InChIKeyIIMKMYPZEFHUPJ-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.96
Rot. Bonds3

About 1,3,3-triethylpiperidine-2,6-dione

1,3,3-triethylpiperidine-2,6-dione (PubChem CID 3028446) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 1,3,3-triethylpiperidine-2,6-dione.

Molecular Properties

Compound Name1,3,3-triethylpiperidine-2,6-dione
PubChem CID3028446
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name1,3,3-triethylpiperidine-2,6-dione
SMILESCCN1C(=O)CCC(CC)(CC)C1=O
InChIInChI=1S/C11H19NO2/c1-4-11(5-2)8-7-9(13)12(6-3)10(11)14/h4-8H2,1-3H3
InChIKeyIIMKMYPZEFHUPJ-UHFFFAOYSA-N
XLogP1.96
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3,3-triethylpiperidine-2,6-dione?
The IUPAC name of 1,3,3-triethylpiperidine-2,6-dione (CID 3028446) is 1,3,3-triethylpiperidine-2,6-dione.
What is the SMILES notation for 1,3,3-triethylpiperidine-2,6-dione?
The canonical SMILES for 1,3,3-triethylpiperidine-2,6-dione is CCN1C(=O)CCC(CC)(CC)C1=O.
What is the InChIKey of 1,3,3-triethylpiperidine-2,6-dione?
The InChIKey is IIMKMYPZEFHUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-4-11(5-2)8-7-9(13)12(6-3)10(11)14/h4-8H2,1-3H3.
What are the key properties of 1,3,3-triethylpiperidine-2,6-dione?
1,3,3-triethylpiperidine-2,6-dione has a molecular weight of 197.28 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3-triethylpiperidine-2,6-dione is sourced from PubChem (CID 3028446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).