3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione

C11H15F3N2O2 — CID 79266293

IUPAC3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
SMILESO=C1CN(CC(F)(F)F)C(=O)N1C1CCCCC1
InChIInChI=1S/C11H15F3N2O2/c12-11(13,14)7-15-6-9(17)16(10(15)18)8-4-2-1-3-5-8/h8H,1-7H2
InChIKeyJFXUSCIGBKWJPG-UHFFFAOYSA-N
MW264.25 g/mol
LogP2.15
Rot. Bonds2

About 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione

3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione (PubChem CID 79266293) has the molecular formula C11H15F3N2O2 and a molecular weight of 264.25 g/mol. Its IUPAC name is 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
PubChem CID79266293
Molecular FormulaC11H15F3N2O2
Molecular Weight264.25 g/mol
Exact Mass264.11
IUPAC Name3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
SMILESO=C1CN(CC(F)(F)F)C(=O)N1C1CCCCC1
InChIInChI=1S/C11H15F3N2O2/c12-11(13,14)7-15-6-9(17)16(10(15)18)8-4-2-1-3-5-8/h8H,1-7H2
InChIKeyJFXUSCIGBKWJPG-UHFFFAOYSA-N
XLogP2.15
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione?
The IUPAC name of 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione (CID 79266293) is 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione is O=C1CN(CC(F)(F)F)C(=O)N1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione?
The InChIKey is JFXUSCIGBKWJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O2/c12-11(13,14)7-15-6-9(17)16(10(15)18)8-4-2-1-3-5-8/h8H,1-7H2.
What are the key properties of 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione?
3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione has a molecular weight of 264.25 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 79266293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).