1-(4-methoxyphenyl)imidazolidine-2,4,5-trione

C10H8N2O4 — CID 4962255

IUPAC1-(4-methoxyphenyl)imidazolidine-2,4,5-trione
SMILESCOc1ccc(N2C(=O)NC(=O)C2=O)cc1
InChIInChI=1S/C10H8N2O4/c1-16-7-4-2-6(3-5-7)12-9(14)8(13)11-10(12)15/h2-5H,1H3,(H,11,13,15)
InChIKeyRHSZIUTWVPFPQV-UHFFFAOYSA-N
MW220.18 g/mol
LogP0.28
Rot. Bonds2

About 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione

1-(4-methoxyphenyl)imidazolidine-2,4,5-trione (PubChem CID 4962255) has the molecular formula C10H8N2O4 and a molecular weight of 220.18 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione.

Molecular Properties

Compound Name1-(4-methoxyphenyl)imidazolidine-2,4,5-trione
PubChem CID4962255
Molecular FormulaC10H8N2O4
Molecular Weight220.18 g/mol
Exact Mass220.05
IUPAC Name1-(4-methoxyphenyl)imidazolidine-2,4,5-trione
SMILESCOc1ccc(N2C(=O)NC(=O)C2=O)cc1
InChIInChI=1S/C10H8N2O4/c1-16-7-4-2-6(3-5-7)12-9(14)8(13)11-10(12)15/h2-5H,1H3,(H,11,13,15)
InChIKeyRHSZIUTWVPFPQV-UHFFFAOYSA-N
XLogP0.28
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.18
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
The IUPAC name of 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione (CID 4962255) is 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione.
What is the SMILES notation for 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
The canonical SMILES for 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione is COc1ccc(N2C(=O)NC(=O)C2=O)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
The InChIKey is RHSZIUTWVPFPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O4/c1-16-7-4-2-6(3-5-7)12-9(14)8(13)11-10(12)15/h2-5H,1H3,(H,11,13,15).
What are the key properties of 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
1-(4-methoxyphenyl)imidazolidine-2,4,5-trione has a molecular weight of 220.18 g/mol, XLogP of 0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)imidazolidine-2,4,5-trione is sourced from PubChem (CID 4962255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).