3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione

C19H19FN2O3 — CID 5026204

IUPAC3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(CN2C(=O)NC(C)(c3ccc(C)cc3)C2=O)cc1F
InChIInChI=1S/C19H19FN2O3/c1-12-4-7-14(8-5-12)19(2)17(23)22(18(24)21-19)11-13-6-9-16(25-3)15(20)10-13/h4-10H,11H2,1-3H3,(H,21,24)
InChIKeyRFEPMWJXQWGOTQ-UHFFFAOYSA-N
MW342.37 g/mol
LogP3.11
Rot. Bonds4

About 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione

3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione (PubChem CID 5026204) has the molecular formula C19H19FN2O3 and a molecular weight of 342.37 g/mol. Its IUPAC name is 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
PubChem CID5026204
Molecular FormulaC19H19FN2O3
Molecular Weight342.37 g/mol
Exact Mass342.14
IUPAC Name3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(CN2C(=O)NC(C)(c3ccc(C)cc3)C2=O)cc1F
InChIInChI=1S/C19H19FN2O3/c1-12-4-7-14(8-5-12)19(2)17(23)22(18(24)21-19)11-13-6-9-16(25-3)15(20)10-13/h4-10H,11H2,1-3H3,(H,21,24)
InChIKeyRFEPMWJXQWGOTQ-UHFFFAOYSA-N
XLogP3.11
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione (CID 5026204) is 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione is COc1ccc(CN2C(=O)NC(C)(c3ccc(C)cc3)C2=O)cc1F.
What is the InChIKey of 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
The InChIKey is RFEPMWJXQWGOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O3/c1-12-4-7-14(8-5-12)19(2)17(23)22(18(24)21-19)11-13-6-9-16(25-3)15(20)10-13/h4-10H,11H2,1-3H3,(H,21,24).
What are the key properties of 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione?
3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione has a molecular weight of 342.37 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 5026204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).