1-ethyl-2,2-dimethylimidazolidine-4,5-dione

C7H12N2O2 — CID 58353459

IUPAC1-ethyl-2,2-dimethylimidazolidine-4,5-dione
SMILESCCN1C(=O)C(=O)NC1(C)C
InChIInChI=1S/C7H12N2O2/c1-4-9-6(11)5(10)8-7(9,2)3/h4H2,1-3H3,(H,8,10)
InChIKeyWTMGSCROJLRYLF-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.30
Rot. Bonds1

About 1-ethyl-2,2-dimethylimidazolidine-4,5-dione

1-ethyl-2,2-dimethylimidazolidine-4,5-dione (PubChem CID 58353459) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 1-ethyl-2,2-dimethylimidazolidine-4,5-dione.

Molecular Properties

Compound Name1-ethyl-2,2-dimethylimidazolidine-4,5-dione
PubChem CID58353459
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name1-ethyl-2,2-dimethylimidazolidine-4,5-dione
SMILESCCN1C(=O)C(=O)NC1(C)C
InChIInChI=1S/C7H12N2O2/c1-4-9-6(11)5(10)8-7(9,2)3/h4H2,1-3H3,(H,8,10)
InChIKeyWTMGSCROJLRYLF-UHFFFAOYSA-N
XLogP-0.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,2-dimethylimidazolidine-4,5-dione?
The IUPAC name of 1-ethyl-2,2-dimethylimidazolidine-4,5-dione (CID 58353459) is 1-ethyl-2,2-dimethylimidazolidine-4,5-dione.
What is the SMILES notation for 1-ethyl-2,2-dimethylimidazolidine-4,5-dione?
The canonical SMILES for 1-ethyl-2,2-dimethylimidazolidine-4,5-dione is CCN1C(=O)C(=O)NC1(C)C.
What is the InChIKey of 1-ethyl-2,2-dimethylimidazolidine-4,5-dione?
The InChIKey is WTMGSCROJLRYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-4-9-6(11)5(10)8-7(9,2)3/h4H2,1-3H3,(H,8,10).
What are the key properties of 1-ethyl-2,2-dimethylimidazolidine-4,5-dione?
1-ethyl-2,2-dimethylimidazolidine-4,5-dione has a molecular weight of 156.19 g/mol, XLogP of -0.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,2-dimethylimidazolidine-4,5-dione is sourced from PubChem (CID 58353459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).