1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione

C19H36N2O2 — CID 174450091

IUPAC1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione
SMILESCCN1CC(=O)N(CC(CC)(CC)CCC(C)(CC)CC)C1=O
InChIInChI=1S/C19H36N2O2/c1-7-18(6,8-2)12-13-19(9-3,10-4)15-21-16(22)14-20(11-5)17(21)23/h7-15H2,1-6H3
InChIKeyMYXSKOGXSQQMMO-UHFFFAOYSA-N
MW324.51 g/mol
LogP4.68
Rot. Bonds10

About 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione

1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione (PubChem CID 174450091) has the molecular formula C19H36N2O2 and a molecular weight of 324.51 g/mol. Its IUPAC name is 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione
PubChem CID174450091
Molecular FormulaC19H36N2O2
Molecular Weight324.51 g/mol
Exact Mass324.28
IUPAC Name1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione
SMILESCCN1CC(=O)N(CC(CC)(CC)CCC(C)(CC)CC)C1=O
InChIInChI=1S/C19H36N2O2/c1-7-18(6,8-2)12-13-19(9-3,10-4)15-21-16(22)14-20(11-5)17(21)23/h7-15H2,1-6H3
InChIKeyMYXSKOGXSQQMMO-UHFFFAOYSA-N
XLogP4.68
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.51
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-3-[15-(3-ethyl-2,5-dioxoimidazolidin-1-yl)-2,2,14,14-tetramethyl-6,10-dioxopentadecyl]imidazolidine-2,4-dione
CID 23083858
3-[2,2-diethyl-6-[6-ethyl-4-(3-ethyl-2,5-dioxoimidazolidin-1-yl)octan-2-yl]oxyhexyl]-1-ethylimidazolidine-2,4-dione
CID 69459287
3-[8-(5,5-dimethylheptoxy)-4,4-dimethyloctyl]-1-ethylimidazolidine-2,4-dione
CID 59296310
3-[9-(5,5-diethylnonoxy)-5,5-diethylnonyl]-1-ethylimidazolidine-2,4-dione
CID 59296333
3-[9-(5,5-diethyldecoxy)-5,5-diethylnonyl]-1-ethylimidazolidine-2,4-dione
CID 59296276
3-[3,3-diethyl-7-[5-ethyl-5-[(3-ethyl-2,5-dioxoimidazolidin-1-yl)methyl]hept-6-enoxy]heptyl]-1-ethylimidazolidine-2,4-dione
CID 59079027
3-[7-(5,5-diethyl-10-hydroxydecoxy)-3,3-diethylheptyl]-1-ethylimidazolidine-2,4-dione;3-[6-(5,5-diethyl-10-hydroxydecoxy)-2,2-diethylhexyl]-1-ethylimidazolidine-2,4-dione;3-[9-(5,5-diethyl-10-hydroxydecoxy)-5,5-diethylnonyl]-1-ethylimidazolidine-2,4-dione;3-[8-(5,5-diethyl-10-hydroxydecoxy)-4,4-diethyloctyl]-1-ethylimidazolidine-2,4-dione;3-[7-(5,5-diethyl-10-hydroxydecoxy)-3-ethylheptan-3-yl]-1-ethylimidazolidine-2,4-dione;3-[7-(5,5-diethyl-9-hydroxynonoxy)-3,3-diethylheptyl]-1-ethylimidazolidine-2,4-dione;3-[6-(5,5-diethyl-9-hydroxynonoxy)-2,2-diethylhexyl]-1-ethylimidazolidine-2,4-dione;3-[8-(5,5-diethyl-9-hydroxynonoxy)-4,4-diethyloctyl]-1-ethylimidazolidine-2,4-dione
CID 160824313
6-[5,5-diethyl-7-(3-ethyl-2,5-dioxoimidazolidin-1-yl)heptoxy]-2-ethyl-2-methylhexanoic acid
CID 59296325
3-[9-[5-ethenyl-5-ethyl-8-(3-ethyl-2,5-dioxoimidazolidin-1-yl)octoxy]-5,5-diethylnonyl]-1-ethylimidazolidine-2,4-dione
CID 59079005
3-[5-[2-(3,3-dimethylbutoxy)ethoxy]-3,3-dimethylpentyl]-1-ethylimidazolidine-2,4-dione
CID 143079825
3-[9-(5,5-dimethyloctoxy)-5,5-dimethylnonyl]-1-ethylimidazolidine-2,4-dione
CID 59296326
3-(5,5-dimethyl-9-pentoxynonyl)-1-ethylimidazolidine-2,4-dione
CID 59111000

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione?
The IUPAC name of 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione (CID 174450091) is 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione is CCN1CC(=O)N(CC(CC)(CC)CCC(C)(CC)CC)C1=O.
What is the InChIKey of 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione?
The InChIKey is MYXSKOGXSQQMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2O2/c1-7-18(6,8-2)12-13-19(9-3,10-4)15-21-16(22)14-20(11-5)17(21)23/h7-15H2,1-6H3.
What are the key properties of 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione?
1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione has a molecular weight of 324.51 g/mol, XLogP of 4.68, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2,2,5-triethyl-5-methylheptyl)imidazolidine-2,4-dione is sourced from PubChem (CID 174450091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).