3-decyl-5,5-diphenylimidazolidine-2,4-dione

C25H32N2O2 — CID 11696827

IUPAC3-decyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCCCCCCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C25H32N2O2/c1-2-3-4-5-6-7-8-15-20-27-23(28)25(26-24(27)29,21-16-11-9-12-17-21)22-18-13-10-14-19-22/h9-14,16-19H,2-8,15,20H2,1H3,(H,26,29)
InChIKeyDQBZMQJEWUDYKT-UHFFFAOYSA-N
MW392.54 g/mol
LogP5.62
Rot. Bonds11

About 3-decyl-5,5-diphenylimidazolidine-2,4-dione

3-decyl-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 11696827) has the molecular formula C25H32N2O2 and a molecular weight of 392.54 g/mol. Its IUPAC name is 3-decyl-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-decyl-5,5-diphenylimidazolidine-2,4-dione
PubChem CID11696827
Molecular FormulaC25H32N2O2
Molecular Weight392.54 g/mol
Exact Mass392.25
IUPAC Name3-decyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCCCCCCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C25H32N2O2/c1-2-3-4-5-6-7-8-15-20-27-23(28)25(26-24(27)29,21-16-11-9-12-17-21)22-18-13-10-14-19-22/h9-14,16-19H,2-8,15,20H2,1H3,(H,26,29)
InChIKeyDQBZMQJEWUDYKT-UHFFFAOYSA-N
XLogP5.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.54
LogP ≤ 55.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
5,5-diphenyl-3-(3-sulfanylpropyl)imidazolidine-2,4-dione
CID 102066490
5,5-diphenyl-3-(4-phenylsulfanylbutyl)imidazolidine-2,4-dione
CID 2221675
2-amino-5-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)pentanoic acid
CID 3084726
3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
CID 51108463
S-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl] 2-aminoethanethioate
CID 54266354
5,5-diphenyl-3-[2-(propan-2-ylamino)ethyl]imidazolidine-2,4-dione
CID 129132203
3-[6-[[di(propan-2-yl)amino]-methoxyphosphanyl]oxyhexyl]-5,5-diphenylimidazolidine-2,4-dione
CID 67922072
ethyl 2-[2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)ethoxy]acetate
CID 75425557
5,5-dibenzyl-1-heptyl-1,3-diazinane-2,4,6-trione
CID 11304322
N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide
CID 70826266
3-[3-(4-isocyano-4-phenylpiperidin-1-yl)propyl]-5,5-diphenylimidazolidine-2,4-dione
CID 22960997

Frequently Asked Questions

What is the IUPAC name of 3-decyl-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-decyl-5,5-diphenylimidazolidine-2,4-dione (CID 11696827) is 3-decyl-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-decyl-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-decyl-5,5-diphenylimidazolidine-2,4-dione is CCCCCCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 3-decyl-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is DQBZMQJEWUDYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N2O2/c1-2-3-4-5-6-7-8-15-20-27-23(28)25(26-24(27)29,21-16-11-9-12-17-21)22-18-13-10-14-19-22/h9-14,16-19H,2-8,15,20H2,1H3,(H,26,29).
What are the key properties of 3-decyl-5,5-diphenylimidazolidine-2,4-dione?
3-decyl-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 392.54 g/mol, XLogP of 5.62, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-decyl-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 11696827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).