5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione

C5H5F3N2O2 — CID 5311800

IUPAC5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
SMILESCC1(C(F)(F)F)NC(=O)NC1=O
InChIInChI=1S/C5H5F3N2O2/c1-4(5(6,7)8)2(11)9-3(12)10-4/h1H3,(H2,9,10,11,12)
InChIKeyNUTFDISMZVUEBO-UHFFFAOYSA-N
MW182.10 g/mol
LogP0.15
Rot. Bonds

About 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione

5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione (PubChem CID 5311800) has the molecular formula C5H5F3N2O2 and a molecular weight of 182.10 g/mol. Its IUPAC name is 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
PubChem CID5311800
Molecular FormulaC5H5F3N2O2
Molecular Weight182.10 g/mol
Exact Mass182.03
IUPAC Name5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
SMILESCC1(C(F)(F)F)NC(=O)NC1=O
InChIInChI=1S/C5H5F3N2O2/c1-4(5(6,7)8)2(11)9-3(12)10-4/h1H3,(H2,9,10,11,12)
InChIKeyNUTFDISMZVUEBO-UHFFFAOYSA-N
XLogP0.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.10
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Dimethylhydantoin
CID 6491
3-Bromo-5,5-dimethylhydantoin
CID 288035
5,5-Dimethylimidazolidine-2,4-dione;formaldehyde
CID 3080741
1-Chloro-5,5-dimethylhydantoin
CID 522340
Sodium 5,5-dimethylhydantoin
CID 165362697
5-(Difluoromethyl)-5-methylimidazolidine-2,4-dione
CID 129995951
Bis(trifluoromethyl)hydantoin
CID 22670459
3-Chloro-5,5-dimethylimidazolidine-2,4-dione
CID 250593
5-Amino-5-trifluoromethylimidazolidine-2,4-dione
CID 129769225
N-iodo-5,5-di-methylhydantoin
CID 9899777
1-Bromo-5,5-dimethylhydantoin
CID 9964414
5-(Fluoromethyl)-5-methylimidazolidine-2,4-dione
CID 237915

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione (CID 5311800) is 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione is CC1(C(F)(F)F)NC(=O)NC1=O.
What is the InChIKey of 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
The InChIKey is NUTFDISMZVUEBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F3N2O2/c1-4(5(6,7)8)2(11)9-3(12)10-4/h1H3,(H2,9,10,11,12).
What are the key properties of 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione has a molecular weight of 182.10 g/mol, XLogP of 0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 5311800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).