3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione

C15H25F3N2O3 — CID 176613625

IUPAC3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione
SMILESCC(C)N1C(=O)N(CCOC(F)(F)F)C(C(C)C)(C(C)C)C1=O
InChIInChI=1S/C15H25F3N2O3/c1-9(2)14(10(3)4)12(21)20(11(5)6)13(22)19(14)7-8-23-15(16,17)18/h9-11H,7-8H2,1-6H3
InChIKeyIMMVCDOBJOGODU-UHFFFAOYSA-N
MW338.37 g/mol
LogP3.25
Rot. Bonds6

About 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione

3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione (PubChem CID 176613625) has the molecular formula C15H25F3N2O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione
PubChem CID176613625
Molecular FormulaC15H25F3N2O3
Molecular Weight338.37 g/mol
Exact Mass338.18
IUPAC Name3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione
SMILESCC(C)N1C(=O)N(CCOC(F)(F)F)C(C(C)C)(C(C)C)C1=O
InChIInChI=1S/C15H25F3N2O3/c1-9(2)14(10(3)4)12(21)20(11(5)6)13(22)19(14)7-8-23-15(16,17)18/h9-11H,7-8H2,1-6H3
InChIKeyIMMVCDOBJOGODU-UHFFFAOYSA-N
XLogP3.25
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-Bis(1-fluoro-2-methoxyethyl)-4,4-di(propan-2-yl)imidazolidin-2-one
CID 139925632
Ethane;5-methyl-3,5-di(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione
CID 168209963
3,5,5-Tri(propan-2-yl)-1-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
CID 176613619
1-(2,2-Difluoroethyl)-3,5,5-tri(propan-2-yl)imidazolidine-2,4-dione
CID 176613659
5,5-Diethyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidine-2,4-dione
CID 64219109
5-Methyl-5-propan-2-yl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidine-2,4-dione
CID 75453537
(5R)-5-methyl-5-propan-2-yl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidine-2,4-dione
CID 97349674
(5S)-5-methyl-5-propan-2-yl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidine-2,4-dione
CID 97349675
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2-methoxyethyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 137842891
5-Methyl-3,5-di(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione
CID 168209964
5-Ethyl-1-(2-methoxyethyl)-3-methyl-5-propan-2-ylimidazolidine-2,4-dione
CID 168208273
1,3,5,5-Tetra(propan-2-yl)imidazolidine-2,4-dione
CID 169698588

Frequently Asked Questions

What is the IUPAC name of 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione?
The IUPAC name of 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione (CID 176613625) is 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione is CC(C)N1C(=O)N(CCOC(F)(F)F)C(C(C)C)(C(C)C)C1=O.
What is the InChIKey of 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione?
The InChIKey is IMMVCDOBJOGODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O3/c1-9(2)14(10(3)4)12(21)20(11(5)6)13(22)19(14)7-8-23-15(16,17)18/h9-11H,7-8H2,1-6H3.
What are the key properties of 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione?
3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione has a molecular weight of 338.37 g/mol, XLogP of 3.25, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,5-tri(propan-2-yl)-1-[2-(trifluoromethoxy)ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 176613625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).