5-(4-hydroxyphenyl)imidazolidine-2,4-dione

C18H16N4O6 — CID 159859205

IUPAC5-(4-hydroxyphenyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccc(O)cc2)N1.O=C1NC(=O)C(c2ccc(O)cc2)N1
InChIInChI=1S/2C9H8N2O3/c2*12-6-3-1-5(2-4-6)7-8(13)11-9(14)10-7/h2*1-4,7,12H,(H2,10,11,13,14)
InChIKeyNQXNAMMDTYLGIJ-UHFFFAOYSA-N
MW384.35 g/mol
LogP0.55
Rot. Bonds2

About 5-(4-hydroxyphenyl)imidazolidine-2,4-dione

5-(4-hydroxyphenyl)imidazolidine-2,4-dione (PubChem CID 159859205) has the molecular formula C18H16N4O6 and a molecular weight of 384.35 g/mol. Its IUPAC name is 5-(4-hydroxyphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4-hydroxyphenyl)imidazolidine-2,4-dione
PubChem CID159859205
Molecular FormulaC18H16N4O6
Molecular Weight384.35 g/mol
Exact Mass384.11
IUPAC Name5-(4-hydroxyphenyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccc(O)cc2)N1.O=C1NC(=O)C(c2ccc(O)cc2)N1
InChIInChI=1S/2C9H8N2O3/c2*12-6-3-1-5(2-4-6)7-8(13)11-9(14)10-7/h2*1-4,7,12H,(H2,10,11,13,14)
InChIKeyNQXNAMMDTYLGIJ-UHFFFAOYSA-N
XLogP0.55
TPSA156.86 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.35
LogP ≤ 50.55
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(4-hydroxyphenyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(4-hydroxyphenyl)imidazolidine-2,4-dione (CID 159859205) is 5-(4-hydroxyphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(4-hydroxyphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(4-hydroxyphenyl)imidazolidine-2,4-dione is O=C1NC(=O)C(c2ccc(O)cc2)N1.O=C1NC(=O)C(c2ccc(O)cc2)N1.
What is the InChIKey of 5-(4-hydroxyphenyl)imidazolidine-2,4-dione?
The InChIKey is NQXNAMMDTYLGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H8N2O3/c2*12-6-3-1-5(2-4-6)7-8(13)11-9(14)10-7/h2*1-4,7,12H,(H2,10,11,13,14).
What are the key properties of 5-(4-hydroxyphenyl)imidazolidine-2,4-dione?
5-(4-hydroxyphenyl)imidazolidine-2,4-dione has a molecular weight of 384.35 g/mol, XLogP of 0.55, 2 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-hydroxyphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 159859205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).