5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione

C17H16N2O2 — CID 135033673

IUPAC5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)C(=O)N1CCc1ccccc1
InChIInChI=1S/C17H16N2O2/c20-16-15(14-9-5-2-6-10-14)18-17(21)19(16)12-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,21)
InChIKeyQRFRKZOCPYBHMX-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.52
Rot. Bonds4

About 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione

5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione (PubChem CID 135033673) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione
PubChem CID135033673
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)C(=O)N1CCc1ccccc1
InChIInChI=1S/C17H16N2O2/c20-16-15(14-9-5-2-6-10-14)18-17(21)19(16)12-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,21)
InChIKeyQRFRKZOCPYBHMX-UHFFFAOYSA-N
XLogP2.52
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Phenytoin
CID 1775
Ethotoin
CID 3292
Mephenytoin
CID 4060
Phenytoin Sodium
CID 657302
Fosphenytoin
CID 56339
Phenylhydantoin
CID 1002
Fosphenytoin Sodium
CID 56338
Mephenytoin, (+)-
CID 107921
Alicapistat
CID 67095330
Doxenitoin
CID 18622
Methetoin
CID 21908
5-(Phenylmethyl)-2,4-imidazolidinedione
CID 73565

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione (CID 135033673) is 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione is O=C1NC(c2ccccc2)C(=O)N1CCc1ccccc1.
What is the InChIKey of 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione?
The InChIKey is QRFRKZOCPYBHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c20-16-15(14-9-5-2-6-10-14)18-17(21)19(16)12-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,18,21).
What are the key properties of 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione?
5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione has a molecular weight of 280.33 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-(2-phenylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 135033673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).