5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione

C20H19F3N2O3 — CID 170608537

IUPAC5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione
SMILESCc1cccc(C(F)(F)F)c1COc1ccc(N2C(=O)NC(C)(C)C2=O)cc1
InChIInChI=1S/C20H19F3N2O3/c1-12-5-4-6-16(20(21,22)23)15(12)11-28-14-9-7-13(8-10-14)25-17(26)19(2,3)24-18(25)27/h4-10H,11H2,1-3H3,(H,24,27)
InChIKeySNHPMFHLVMILHL-UHFFFAOYSA-N
MW392.38 g/mol
LogP4.43
Rot. Bonds4

About 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione

5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione (PubChem CID 170608537) has the molecular formula C20H19F3N2O3 and a molecular weight of 392.38 g/mol. Its IUPAC name is 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione
PubChem CID170608537
Molecular FormulaC20H19F3N2O3
Molecular Weight392.38 g/mol
Exact Mass392.13
IUPAC Name5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione
SMILESCc1cccc(C(F)(F)F)c1COc1ccc(N2C(=O)NC(C)(C)C2=O)cc1
InChIInChI=1S/C20H19F3N2O3/c1-12-5-4-6-16(20(21,22)23)15(12)11-28-14-9-7-13(8-10-14)25-17(26)19(2,3)24-18(25)27/h4-10H,11H2,1-3H3,(H,24,27)
InChIKeySNHPMFHLVMILHL-UHFFFAOYSA-N
XLogP4.43
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.38
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5,5-dimethyl-3-[4-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
CID 3054228
[1-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]triazol-4-yl]methanol
CID 170608612
5,5-dimethyl-3-[4-[4-methyl-3-(trifluoromethoxy)phenoxy]phenyl]imidazolidine-2,4-dione
CID 146563952
3-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-5,5-dimethylimidazolidine-2,4-dione
CID 53241836
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile
CID 11162285
3-[4-[[2-(1,1-difluoroethyl)-6-methylphenyl]methoxy]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 174303112
3-(3-hydroxy-4-methylphenyl)-5,5-dimethylimidazolidine-2,4-dione
CID 143951007
1-[2-[2-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-2,4-dioxoimidazolidin-1-yl]ethoxy]ethyl]-5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione;5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
CID 157314100
5-methyl-3-phenyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 79801017
2-[[5-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-pyridinyl]oxy]-3-methylbenzonitrile
CID 129216936
1-[7-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-2,4-dioxoimidazolidin-1-yl]heptyl]-5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione;5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
CID 160756691
5-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-3-(trifluoromethyl)benzene-1,2-dicarbonitrile
CID 15838444

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione (CID 170608537) is 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione is Cc1cccc(C(F)(F)F)c1COc1ccc(N2C(=O)NC(C)(C)C2=O)cc1.
What is the InChIKey of 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione?
The InChIKey is SNHPMFHLVMILHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F3N2O3/c1-12-5-4-6-16(20(21,22)23)15(12)11-28-14-9-7-13(8-10-14)25-17(26)19(2,3)24-18(25)27/h4-10H,11H2,1-3H3,(H,24,27).
What are the key properties of 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione?
5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione has a molecular weight of 392.38 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-[4-[[2-methyl-6-(trifluoromethyl)phenyl]methoxy]phenyl]imidazolidine-2,4-dione is sourced from PubChem (CID 170608537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).