5-phenacylimidazolidine-2,4-dione

C11H10N2O3 — CID 15716927

IUPAC5-phenacylimidazolidine-2,4-dione
SMILESO=C1NC(=O)C(CC(=O)c2ccccc2)N1
InChIInChI=1S/C11H10N2O3/c14-9(7-4-2-1-3-5-7)6-8-10(15)13-11(16)12-8/h1-5,8H,6H2,(H2,12,13,15,16)
InChIKeyWZAXXPARYVNMBB-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.47
Rot. Bonds3

About 5-phenacylimidazolidine-2,4-dione

5-phenacylimidazolidine-2,4-dione (PubChem CID 15716927) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is 5-phenacylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-phenacylimidazolidine-2,4-dione
PubChem CID15716927
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name5-phenacylimidazolidine-2,4-dione
SMILESO=C1NC(=O)C(CC(=O)c2ccccc2)N1
InChIInChI=1S/C11H10N2O3/c14-9(7-4-2-1-3-5-7)6-8-10(15)13-11(16)12-8/h1-5,8H,6H2,(H2,12,13,15,16)
InChIKeyWZAXXPARYVNMBB-UHFFFAOYSA-N
XLogP0.47
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5S)-5-phenacyl-1,3-thiazolidine-2,4-dione
CID 7013183
5-phenacyl-6-phenyl-4,5-dihydro-2H-1,2,4-triazin-3-one
CID 56692518
(5S)-5-(phenyl(113C)methyl)imidazolidine-2,4-dione
CID 53360215
3-phenacyl-2,3-dihydroisoindol-1-one
CID 10857928
(3S)-4-fluoro-3-phenacyl-2,3-dihydroisoindol-1-one
CID 164681162
1-[2-(2,5-dioxoimidazolidin-4-yl)ethyl]-3-phenylurea
CID 110748117
(5R)-5-[3-(4-benzoylpiperazin-1-yl)-3-oxopropyl]imidazolidine-2,4-dione
CID 94150710
2-imino-5-phenacyl-1,3-thiazolidin-4-one
CID 138978177
N-(2,3-dihydro-1H-inden-2-yl)-2-[(4S)-2,5-dioxoimidazolidin-4-yl]-N-methylacetamide
CID 94646397
cis-(2S,3R)-2-benzoyl-3-phenacylcyclopentan-1-one
CID 131848782
1,3-diphenylpropane-1,3-dione;dihydrofluoride
CID 159485423
2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide
CID 47150286

Frequently Asked Questions

What is the IUPAC name of 5-phenacylimidazolidine-2,4-dione?
The IUPAC name of 5-phenacylimidazolidine-2,4-dione (CID 15716927) is 5-phenacylimidazolidine-2,4-dione.
What is the SMILES notation for 5-phenacylimidazolidine-2,4-dione?
The canonical SMILES for 5-phenacylimidazolidine-2,4-dione is O=C1NC(=O)C(CC(=O)c2ccccc2)N1.
What is the InChIKey of 5-phenacylimidazolidine-2,4-dione?
The InChIKey is WZAXXPARYVNMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c14-9(7-4-2-1-3-5-7)6-8-10(15)13-11(16)12-8/h1-5,8H,6H2,(H2,12,13,15,16).
What are the key properties of 5-phenacylimidazolidine-2,4-dione?
5-phenacylimidazolidine-2,4-dione has a molecular weight of 218.21 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenacylimidazolidine-2,4-dione is sourced from PubChem (CID 15716927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).