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

C16H12N2O3 — CID 4599781

IUPAC5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
SMILESO=C1NC(=Cc2ccc(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)
InChIKeyGDCDCQPHXUBWMG-UHFFFAOYSA-N
MW280.28 g/mol
LogP2.49
Rot. Bonds2

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

5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione (PubChem CID 4599781) has the molecular formula C16H12N2O3 and a molecular weight of 280.28 g/mol. Its IUPAC name is 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
PubChem CID4599781
Molecular FormulaC16H12N2O3
Molecular Weight280.28 g/mol
Exact Mass280.08
IUPAC Name5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
SMILESO=C1NC(=Cc2ccc(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)
InChIKeyGDCDCQPHXUBWMG-UHFFFAOYSA-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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Related Compounds

(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one
CID 2133161
3-phenyl-5-[(4-phenylphenyl)methylidene]imidazolidine-2,4-dione
CID 2928322
(5E)-3-phenyl-5-[(4-piperidin-1-ylphenyl)methylidene]imidazolidine-2,4-dione
CID 2177673
(5E)-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
CID 126027410
2-[4-[(E)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]phenoxy]acetate
CID 7269294
N-(4-chlorophenyl)-4-[(4Z)-4-[(4-hydroxyphenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]benzamide
CID 127042646
4-[[1-(4-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]benzoic acid
CID 900674
5-[(4-butan-2-yloxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
CID 2929418
(5E)-3-phenyl-5-[(3,4,5-trimethoxyphenyl)methylidene]imidazolidine-2,4-dione
CID 1209667
2-[4-[(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]phenoxy]-N-phenylacetamide
CID 2925783
(5Z)-3-ethyl-5-[(4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
CID 126554488
(5Z)-5-[(2-hydroxy-3-methoxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione
CID 2177829

Frequently Asked Questions

What is the IUPAC name of 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The IUPAC name of 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione (CID 4599781) is 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The canonical SMILES for 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione is O=C1NC(=Cc2ccc(O)cc2)C(=O)N1c1ccccc1.
What is the InChIKey of 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The InChIKey is GDCDCQPHXUBWMG-UHFFFAOYSA-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).
What are the key properties of 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
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 5-[(4-hydroxyphenyl)methylidene]-3-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 4599781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).