3,3-diethyl-1,5-dimethylpiperidine-2,4-dione

C11H19NO2 — CID 154125382

IUPAC3,3-diethyl-1,5-dimethylpiperidine-2,4-dione
SMILESCCC1(CC)C(=O)C(C)CN(C)C1=O
InChIInChI=1S/C11H19NO2/c1-5-11(6-2)9(13)8(3)7-12(4)10(11)14/h8H,5-7H2,1-4H3
InChIKeyREZIHXGNFGIVIW-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.47
Rot. Bonds2

About 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione

3,3-diethyl-1,5-dimethylpiperidine-2,4-dione (PubChem CID 154125382) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione.

Molecular Properties

Compound Name3,3-diethyl-1,5-dimethylpiperidine-2,4-dione
PubChem CID154125382
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name3,3-diethyl-1,5-dimethylpiperidine-2,4-dione
SMILESCCC1(CC)C(=O)C(C)CN(C)C1=O
InChIInChI=1S/C11H19NO2/c1-5-11(6-2)9(13)8(3)7-12(4)10(11)14/h8H,5-7H2,1-4H3
InChIKeyREZIHXGNFGIVIW-UHFFFAOYSA-N
XLogP1.47
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-ethyl-1,3,3,4-tetramethylpiperazin-2-one
CID 175555162
(3R)-3-butan-2-yl-3-hydroxy-1,4-dimethylpyrrolidin-2-one
CID 170405095
1,4-dimethyl-3,3-bis(methylsulfanyl)pyrrolidin-2-one
CID 134297864
3-[(1,4-dimethylpiperazin-2-yl)methyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83264810
5-ethyl-2,5-dimethyl-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065491
3-cyclopropyl-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83242982
2,2-diethylcyclopentane-1,3-dione
CID 10464532
(3R)-3-hydroxy-1,4-dimethyl-3-propan-2-ylpyrrolidin-2-one
CID 155363840
5-ethyl-2,5-dimethyl-3-(5-methylhexyl)imidazolidin-4-one
CID 83260814
N-ethyl-3-methyl-4-oxopiperidine-1-sulfonamide
CID 114808687
3,3-diethyl-1-methylpyridine-2,4-dione
CID 23271133
3-(3,5-dimethylcyclohexyl)-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83258740

Frequently Asked Questions

What is the IUPAC name of 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione?
The IUPAC name of 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione (CID 154125382) is 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione.
What is the SMILES notation for 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione?
The canonical SMILES for 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione is CCC1(CC)C(=O)C(C)CN(C)C1=O.
What is the InChIKey of 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione?
The InChIKey is REZIHXGNFGIVIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-5-11(6-2)9(13)8(3)7-12(4)10(11)14/h8H,5-7H2,1-4H3.
What are the key properties of 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione?
3,3-diethyl-1,5-dimethylpiperidine-2,4-dione has a molecular weight of 197.28 g/mol, XLogP of 1.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethyl-1,5-dimethylpiperidine-2,4-dione is sourced from PubChem (CID 154125382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).