3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione

C9H16N2O3 — CID 593536

IUPAC3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione
SMILESCCOC(C)N1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C9H16N2O3/c1-5-14-6(2)11-7(12)9(3,4)10-8(11)13/h6H,5H2,1-4H3,(H,10,13)
InChIKeyMUFWYYZLOKVZKR-UHFFFAOYSA-N
MW200.24 g/mol
LogP0.70
Rot. Bonds3

About 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione

3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 593536) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione
PubChem CID593536
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione
SMILESCCOC(C)N1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C9H16N2O3/c1-5-14-6(2)11-7(12)9(3,4)10-8(11)13/h6H,5H2,1-4H3,(H,10,13)
InChIKeyMUFWYYZLOKVZKR-UHFFFAOYSA-N
XLogP0.70
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Ethyl-5,5-dimethylimidazolidine-2,4-dione
CID 588189
2,4-Imidazolidinedione, 5,5-dimethyl-3-[3-(triethoxysilyl)propyl]-
CID 46179117
3-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)propanenitrile
CID 597160
Hydantoin, 3-(3-chloromethoxypropyl)-5,5-dimethyl-
CID 44699
3-(2-(Diethylamino)ethyl)-5,5-dimethylhydantoin
CID 3028666
5,5-Dimethyl-3-(2-morpholin-4-ylethyl)imidazolidine-2,4-dione
CID 35429407
5,5-Dimethyl-3-(2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
CID 47013852
5,5-Dimethyl-3-[2-(4-methylpiperazin-1-yl)ethyl]imidazolidine-2,4-dione
CID 137649325
3-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)propyl-trimethylazanium chloride
CID 155562366
3-(2-(Dimethylamino)ethyl)-5,5-dimethylhydantoin
CID 298086
Stk384365
CID 339374
2-(5,5-Dimethyl-2,4-dioxoimidazolidin-1-yl)acetamide
CID 54593779

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione (CID 593536) is 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione is CCOC(C)N1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is MUFWYYZLOKVZKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-5-14-6(2)11-7(12)9(3,4)10-8(11)13/h6H,5H2,1-4H3,(H,10,13).
What are the key properties of 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione?
3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 200.24 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethoxyethyl)-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 593536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).