3,3,5-triethylpiperidine-2,4,6-trione

C11H17NO3 — CID 121218732

IUPAC3,3,5-triethylpiperidine-2,4,6-trione
SMILESCCC1C(=O)NC(=O)C(CC)(CC)C1=O
InChIInChI=1S/C11H17NO3/c1-4-7-8(13)11(5-2,6-3)10(15)12-9(7)14/h7H,4-6H2,1-3H3,(H,12,14,15)
InChIKeyGLOGKFKYXRMIMG-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.04
Rot. Bonds3

About 3,3,5-triethylpiperidine-2,4,6-trione

3,3,5-triethylpiperidine-2,4,6-trione (PubChem CID 121218732) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 3,3,5-triethylpiperidine-2,4,6-trione.

Molecular Properties

Compound Name3,3,5-triethylpiperidine-2,4,6-trione
PubChem CID121218732
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name3,3,5-triethylpiperidine-2,4,6-trione
SMILESCCC1C(=O)NC(=O)C(CC)(CC)C1=O
InChIInChI=1S/C11H17NO3/c1-4-7-8(13)11(5-2,6-3)10(15)12-9(7)14/h7H,4-6H2,1-3H3,(H,12,14,15)
InChIKeyGLOGKFKYXRMIMG-UHFFFAOYSA-N
XLogP1.04
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

ethane;5-ethyl-1,3-diazinane-2,4,6-trione
CID 142836832
5,5-diethyl-1,3-diazinane-2,4,6-trione;hydrochloride
CID 22163315
3,6-diethyl-3-methylpiperazine-2,5-dione
CID 64883670
4-ethyl-3,3-dimethylpyrrolidine-2,5-dione
CID 523535
sodium;5,5-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione;hydride
CID 173031111
5,5-diethyl-1-(4-ethylcyclohexyl)-1,3-diazinane-2,4,6-trione
CID 115947509
5,5-diethyl-1,3-diazinane-4,6-dione
CID 130004864
3-ethyl-5-methyl-5-phenylpyrrolidine-2,4-dione
CID 19438036
1-cycloheptyl-5,5-diethyl-1,3-diazinane-2,4,6-trione
CID 115946696
3-ethyl-4-hydroxy-3-methylpyrrolidine-2,5-dione
CID 54322773
5-tert-butyl-3-ethyl-1,3-dihydroindol-2-one
CID 106987056
1-(2,2-dicyclopropylethyl)-5,5-diethyl-1,3-diazinane-2,4,6-trione
CID 115948579

Frequently Asked Questions

What is the IUPAC name of 3,3,5-triethylpiperidine-2,4,6-trione?
The IUPAC name of 3,3,5-triethylpiperidine-2,4,6-trione (CID 121218732) is 3,3,5-triethylpiperidine-2,4,6-trione.
What is the SMILES notation for 3,3,5-triethylpiperidine-2,4,6-trione?
The canonical SMILES for 3,3,5-triethylpiperidine-2,4,6-trione is CCC1C(=O)NC(=O)C(CC)(CC)C1=O.
What is the InChIKey of 3,3,5-triethylpiperidine-2,4,6-trione?
The InChIKey is GLOGKFKYXRMIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-4-7-8(13)11(5-2,6-3)10(15)12-9(7)14/h7H,4-6H2,1-3H3,(H,12,14,15).
What are the key properties of 3,3,5-triethylpiperidine-2,4,6-trione?
3,3,5-triethylpiperidine-2,4,6-trione has a molecular weight of 211.26 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5-triethylpiperidine-2,4,6-trione is sourced from PubChem (CID 121218732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).