2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide

C17H16F3NO4 — CID 55759707

IUPAC2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
SMILESO=C(COCCOc1ccccc1)Nc1ccccc1OC(F)(F)F
InChIInChI=1S/C17H16F3NO4/c18-17(19,20)25-15-9-5-4-8-14(15)21-16(22)12-23-10-11-24-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,21,22)
InChIKeyOCSWWRNGBUSPJF-UHFFFAOYSA-N
MW355.31 g/mol
LogP3.62
Rot. Bonds8

About 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide

2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide (PubChem CID 55759707) has the molecular formula C17H16F3NO4 and a molecular weight of 355.31 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
PubChem CID55759707
Molecular FormulaC17H16F3NO4
Molecular Weight355.31 g/mol
Exact Mass355.10
IUPAC Name2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
SMILESO=C(COCCOc1ccccc1)Nc1ccccc1OC(F)(F)F
InChIInChI=1S/C17H16F3NO4/c18-17(19,20)25-15-9-5-4-8-14(15)21-16(22)12-23-10-11-24-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,21,22)
InChIKeyOCSWWRNGBUSPJF-UHFFFAOYSA-N
XLogP3.62
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide 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

2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 79463675
2-(4-methylphenoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 35202525
N-(4-fluoro-2-methoxyphenyl)-2-(2-phenoxyethoxy)acetamide
CID 86998252
3-bromo-N-[2-(trifluoromethoxy)phenyl]propanamide
CID 112683678
6-oxo-6-[2-(trifluoromethoxy)anilino]hexanoic acid
CID 43529543
2-(2-methoxyphenoxy)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 17130870
N,N'-bis[2-(2-phenoxyethoxy)phenyl]pentanediamide
CID 17131186
3,4-dimethoxy-5-[[2-(2-phenoxyethoxy)acetyl]amino]benzoic acid
CID 119214155
N,N'-bis[2-(2-phenoxyethoxy)phenyl]decanediamide
CID 17130993
2-phenoxy-N-[2-(trifluoromethoxy)phenyl]butanamide
CID 42922033
2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 46995681
N-[2-(4-ethoxyphenoxy)phenyl]-2-(2-methoxyethoxy)acetamide
CID 43037548

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide (CID 55759707) is 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide is O=C(COCCOc1ccccc1)Nc1ccccc1OC(F)(F)F.
What is the InChIKey of 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is OCSWWRNGBUSPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3NO4/c18-17(19,20)25-15-9-5-4-8-14(15)21-16(22)12-23-10-11-24-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,21,22).
What are the key properties of 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 355.31 g/mol, XLogP of 3.62, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 55759707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).