3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione

C8H14N2O3 — CID 130653587

IUPAC3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione
SMILESCCON1C(=O)NC(C)(CC)C1=O
InChIInChI=1S/C8H14N2O3/c1-4-8(3)6(11)10(13-5-2)7(12)9-8/h4-5H2,1-3H3,(H,9,12)
InChIKeyMFPRSGDSGPGYGU-UHFFFAOYSA-N
MW186.21 g/mol
LogP0.66
Rot. Bonds3

About 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione

3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione (PubChem CID 130653587) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione
PubChem CID130653587
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione
SMILESCCON1C(=O)NC(C)(CC)C1=O
InChIInChI=1S/C8H14N2O3/c1-4-8(3)6(11)10(13-5-2)7(12)9-8/h4-5H2,1-3H3,(H,9,12)
InChIKeyMFPRSGDSGPGYGU-UHFFFAOYSA-N
XLogP0.66
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione?
The IUPAC name of 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione (CID 130653587) is 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione is CCON1C(=O)NC(C)(CC)C1=O.
What is the InChIKey of 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione?
The InChIKey is MFPRSGDSGPGYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-4-8(3)6(11)10(13-5-2)7(12)9-8/h4-5H2,1-3H3,(H,9,12).
What are the key properties of 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione?
3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione has a molecular weight of 186.21 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-5-ethyl-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 130653587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).