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

C21H24N2O2 — CID 24860362

IUPAC3-hexyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C21H24N2O2/c1-2-3-4-11-16-23-19(24)21(22-20(23)25,17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-10,12-15H,2-4,11,16H2,1H3,(H,22,25)
InChIKeyJYVFPSMCKDDFLU-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.06
Rot. Bonds7

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

3-hexyl-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 24860362) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 3-hexyl-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-hexyl-5,5-diphenylimidazolidine-2,4-dione
PubChem CID24860362
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name3-hexyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C21H24N2O2/c1-2-3-4-11-16-23-19(24)21(22-20(23)25,17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-10,12-15H,2-4,11,16H2,1H3,(H,22,25)
InChIKeyJYVFPSMCKDDFLU-UHFFFAOYSA-N
XLogP4.06
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.06
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'}

Analyze 3-hexyl-5,5-diphenylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827
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-hexyl-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-hexyl-5,5-diphenylimidazolidine-2,4-dione (CID 24860362) is 3-hexyl-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-hexyl-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-hexyl-5,5-diphenylimidazolidine-2,4-dione is CCCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 3-hexyl-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is JYVFPSMCKDDFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c1-2-3-4-11-16-23-19(24)21(22-20(23)25,17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-10,12-15H,2-4,11,16H2,1H3,(H,22,25).
What are the key properties of 3-hexyl-5,5-diphenylimidazolidine-2,4-dione?
3-hexyl-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 336.44 g/mol, XLogP of 4.06, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hexyl-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 24860362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).