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

C23H18N2O3 — CID 2453894

IUPAC3-phenacyl-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C(CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)c1ccccc1
InChIInChI=1S/C23H18N2O3/c26-20(17-10-4-1-5-11-17)16-25-21(27)23(24-22(25)28,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16H2,(H,24,28)
InChIKeyGKEMKZPBLACIKP-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.36
Rot. Bonds5

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

3-phenacyl-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 2453894) has the molecular formula C23H18N2O3 and a molecular weight of 370.41 g/mol. Its IUPAC name is 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-phenacyl-5,5-diphenylimidazolidine-2,4-dione
PubChem CID2453894
Molecular FormulaC23H18N2O3
Molecular Weight370.41 g/mol
Exact Mass370.13
IUPAC Name3-phenacyl-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C(CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)c1ccccc1
InChIInChI=1S/C23H18N2O3/c26-20(17-10-4-1-5-11-17)16-25-21(27)23(24-22(25)28,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16H2,(H,24,28)
InChIKeyGKEMKZPBLACIKP-UHFFFAOYSA-N
XLogP3.36
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione (CID 2453894) is 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione is O=C(CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)c1ccccc1.
What is the InChIKey of 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is GKEMKZPBLACIKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O3/c26-20(17-10-4-1-5-11-17)16-25-21(27)23(24-22(25)28,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16H2,(H,24,28).
What are the key properties of 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione?
3-phenacyl-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 370.41 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenacyl-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 2453894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).