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

C9H16N2O2 — CID 54082161

IUPAC1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN1C(=O)N(CC)C(C)(C)C1=O
InChIInChI=1S/C9H16N2O2/c1-5-10-7(12)9(3,4)11(6-2)8(10)13/h5-6H2,1-4H3
InChIKeyMNWMUWVJGQDYNQ-UHFFFAOYSA-N
MW184.24 g/mol
LogP1.07
Rot. Bonds2

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

1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 54082161) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione
PubChem CID54082161
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN1C(=O)N(CC)C(C)(C)C1=O
InChIInChI=1S/C9H16N2O2/c1-5-10-7(12)9(3,4)11(6-2)8(10)13/h5-6H2,1-4H3
InChIKeyMNWMUWVJGQDYNQ-UHFFFAOYSA-N
XLogP1.07
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione (CID 54082161) is 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione is CCN1C(=O)N(CC)C(C)(C)C1=O.
What is the InChIKey of 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is MNWMUWVJGQDYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-5-10-7(12)9(3,4)11(6-2)8(10)13/h5-6H2,1-4H3.
What are the key properties of 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione?
1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 184.24 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 54082161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).