2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide

C10H14F3N3O4 — CID 82721364

IUPAC2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide
SMILESCCC1(C)NC(=O)N(CC(=O)NOCC(F)(F)F)C1=O
InChIInChI=1S/C10H14F3N3O4/c1-3-9(2)7(18)16(8(19)14-9)4-6(17)15-20-5-10(11,12)13/h3-5H2,1-2H3,(H,14,19)(H,15,17)
InChIKeyPTUQZXDJFAOGDF-UHFFFAOYSA-N
MW297.23 g/mol
LogP0.32
Rot. Bonds5

About 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide

2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 82721364) has the molecular formula C10H14F3N3O4 and a molecular weight of 297.23 g/mol. Its IUPAC name is 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound Name2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide
PubChem CID82721364
Molecular FormulaC10H14F3N3O4
Molecular Weight297.23 g/mol
Exact Mass297.09
IUPAC Name2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide
SMILESCCC1(C)NC(=O)N(CC(=O)NOCC(F)(F)F)C1=O
InChIInChI=1S/C10H14F3N3O4/c1-3-9(2)7(18)16(8(19)14-9)4-6(17)15-20-5-10(11,12)13/h3-5H2,1-2H3,(H,14,19)(H,15,17)
InChIKeyPTUQZXDJFAOGDF-UHFFFAOYSA-N
XLogP0.32
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.23
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide (CID 82721364) is 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide is CCC1(C)NC(=O)N(CC(=O)NOCC(F)(F)F)C1=O.
What is the InChIKey of 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is PTUQZXDJFAOGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3O4/c1-3-9(2)7(18)16(8(19)14-9)4-6(17)15-20-5-10(11,12)13/h3-5H2,1-2H3,(H,14,19)(H,15,17).
What are the key properties of 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide?
2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 297.23 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 82721364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).