5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione

C13H16N2O4 — CID 71683812

IUPAC5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione
SMILESCCC1(c2ccc(OC)c(OC)c2)NC(=O)NC1=O
InChIInChI=1S/C13H16N2O4/c1-4-13(11(16)14-12(17)15-13)8-5-6-9(18-2)10(7-8)19-3/h5-7H,4H2,1-3H3,(H2,14,15,16,17)
InChIKeyKUXDOFLTBXZAIM-UHFFFAOYSA-N
MW264.28 g/mol
LogP1.15
Rot. Bonds4

About 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione

5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione (PubChem CID 71683812) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione
PubChem CID71683812
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione
SMILESCCC1(c2ccc(OC)c(OC)c2)NC(=O)NC1=O
InChIInChI=1S/C13H16N2O4/c1-4-13(11(16)14-12(17)15-13)8-5-6-9(18-2)10(7-8)19-3/h5-7H,4H2,1-3H3,(H2,14,15,16,17)
InChIKeyKUXDOFLTBXZAIM-UHFFFAOYSA-N
XLogP1.15
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-ethyl-5-(4-methoxy-3-methylphenyl)imidazolidine-2,4-dione
CID 71683811
5-ethyl-5-(4-methoxy-3-nitrophenyl)imidazolidine-2,4-dione
CID 82098446
(5S)-5-(3,4-dimethoxyphenyl)-5-methylimidazolidine-2,4-dione
CID 2384607
(5S)-5-ethyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 7128778
(5S)-5-[(3,4-dimethoxyphenyl)methyl]-5-methylimidazolidine-2,4-dione
CID 2063611
5-ethyl-5-[2-[(4S)-4-[(4-fluoro-5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]-1-benzofuran-5-yl]imidazolidine-2,4-dione
CID 58053832
5-(3,4-dimethoxyphenyl)-3-ethyl-5-methylimidazolidine-2,4-dione
CID 42915163
5-(4-methoxy-3-methylphenyl)-5-(4-methoxyphenyl)imidazolidine-2,4-dione
CID 3058198
2-ethyl-4-methoxy-1-prop-1-en-2-ylbenzene;5-ethyl-5-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
CID 143510343
5-(3,4-dimethoxyphenyl)-5-methylpiperazine-2,3-dione
CID 116856099
5-(2,4-dichlorophenyl)-5-ethylimidazolidine-2,4-dione
CID 82098439
(5R)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-5-ethyl-5-(4-methoxyphenyl)imidazolidine-2,4-dione
CID 7595570

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione?
The IUPAC name of 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione (CID 71683812) is 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione.
What is the SMILES notation for 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione?
The canonical SMILES for 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione is CCC1(c2ccc(OC)c(OC)c2)NC(=O)NC1=O.
What is the InChIKey of 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione?
The InChIKey is KUXDOFLTBXZAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4/c1-4-13(11(16)14-12(17)15-13)8-5-6-9(18-2)10(7-8)19-3/h5-7H,4H2,1-3H3,(H2,14,15,16,17).
What are the key properties of 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione?
5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione has a molecular weight of 264.28 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dimethoxyphenyl)-5-ethylimidazolidine-2,4-dione is sourced from PubChem (CID 71683812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).