N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide

C14H14F3N3O3 — CID 2968207

IUPACN-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide
SMILESCC(=O)NC1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O
InChIInChI=1S/C14H14F3N3O3/c1-9(21)18-13(14(15,16)17)11(22)20(12(23)19-13)8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,18,21)(H,19,23)
InChIKeyDXXYOJFVUFRFKY-UHFFFAOYSA-N
MW329.28 g/mol
LogP1.18
Rot. Bonds4

About N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide

N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide (PubChem CID 2968207) has the molecular formula C14H14F3N3O3 and a molecular weight of 329.28 g/mol. Its IUPAC name is N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide
PubChem CID2968207
Molecular FormulaC14H14F3N3O3
Molecular Weight329.28 g/mol
Exact Mass329.10
IUPAC NameN-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide
SMILESCC(=O)NC1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O
InChIInChI=1S/C14H14F3N3O3/c1-9(21)18-13(14(15,16)17)11(22)20(12(23)19-13)8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,18,21)(H,19,23)
InChIKeyDXXYOJFVUFRFKY-UHFFFAOYSA-N
XLogP1.18
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.28
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]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 N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide?
The IUPAC name of N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide (CID 2968207) is N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide.
What is the SMILES notation for N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide?
The canonical SMILES for N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide is CC(=O)NC1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O.
What is the InChIKey of N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide?
The InChIKey is DXXYOJFVUFRFKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3O3/c1-9(21)18-13(14(15,16)17)11(22)20(12(23)19-13)8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,18,21)(H,19,23).
What are the key properties of N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide?
N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide has a molecular weight of 329.28 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,5-dioxo-1-(2-phenylethyl)-4-(trifluoromethyl)imidazolidin-4-yl]acetamide is sourced from PubChem (CID 2968207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).