(5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione

C16H12N2O3 — CID 7299314

IUPAC(5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
SMILESO=C1N/C(=C/c2ccc(O)cc2)C(=O)N1c1ccccc1
InChIInChI=1S/C16H12N2O3/c19-13-8-6-11(7-9-13)10-14-15(20)18(16(21)17-14)12-4-2-1-3-5-12/h1-10,19H,(H,17,21)/b14-10+
InChIKeyGDCDCQPHXUBWMG-GXDHUFHOSA-N
MW280.28 g/mol
LogP2.49
Rot. Bonds2

About (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione

(5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione (PubChem CID 7299314) has the molecular formula C16H12N2O3 and a molecular weight of 280.28 g/mol. Its IUPAC name is (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
PubChem CID7299314
Molecular FormulaC16H12N2O3
Molecular Weight280.28 g/mol
Exact Mass280.08
IUPAC Name(5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
SMILESO=C1N/C(=C/c2ccc(O)cc2)C(=O)N1c1ccccc1
InChIInChI=1S/C16H12N2O3/c19-13-8-6-11(7-9-13)10-14-15(20)18(16(21)17-14)12-4-2-1-3-5-12/h1-10,19H,(H,17,21)/b14-10+
InChIKeyGDCDCQPHXUBWMG-GXDHUFHOSA-N
XLogP2.49
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The IUPAC name of (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione (CID 7299314) is (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione.
What is the SMILES notation for (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The canonical SMILES for (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione is O=C1N/C(=C/c2ccc(O)cc2)C(=O)N1c1ccccc1.
What is the InChIKey of (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The InChIKey is GDCDCQPHXUBWMG-GXDHUFHOSA-N. The full InChI is InChI=1S/C16H12N2O3/c19-13-8-6-11(7-9-13)10-14-15(20)18(16(21)17-14)12-4-2-1-3-5-12/h1-10,19H,(H,17,21)/b14-10+.
What are the key properties of (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
(5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione has a molecular weight of 280.28 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 7299314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).