5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione

C17H16N2O4 — CID 2339366

IUPAC5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)NC2=O)cc1
InChIInChI=1S/C17H16N2O4/c1-22-13-7-3-11(4-8-13)17(15(20)18-16(21)19-17)12-5-9-14(23-2)10-6-12/h3-10H,1-2H3,(H2,18,19,20,21)
InChIKeyHUULDKVZAIILJR-UHFFFAOYSA-N
MW312.33 g/mol
LogP1.79
Rot. Bonds4

About 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione

5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione (PubChem CID 2339366) has the molecular formula C17H16N2O4 and a molecular weight of 312.33 g/mol. Its IUPAC name is 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione
PubChem CID2339366
Molecular FormulaC17H16N2O4
Molecular Weight312.33 g/mol
Exact Mass312.11
IUPAC Name5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(C2(c3ccc(OC)cc3)NC(=O)NC2=O)cc1
InChIInChI=1S/C17H16N2O4/c1-22-13-7-3-11(4-8-13)17(15(20)18-16(21)19-17)12-5-9-14(23-2)10-6-12/h3-10H,1-2H3,(H2,18,19,20,21)
InChIKeyHUULDKVZAIILJR-UHFFFAOYSA-N
XLogP1.79
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione (CID 2339366) is 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione is COc1ccc(C2(c3ccc(OC)cc3)NC(=O)NC2=O)cc1.
What is the InChIKey of 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione?
The InChIKey is HUULDKVZAIILJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O4/c1-22-13-7-3-11(4-8-13)17(15(20)18-16(21)19-17)12-5-9-14(23-2)10-6-12/h3-10H,1-2H3,(H2,18,19,20,21).
What are the key properties of 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione?
5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione has a molecular weight of 312.33 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(4-methoxyphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 2339366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).