2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide

C16H14F3NO2 — CID 9095297

IUPAC2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ccc(F)c(F)c2F)cc1
InChIInChI=1S/C16H14F3NO2/c1-2-10-3-5-11(6-4-10)22-9-14(21)20-13-8-7-12(17)15(18)16(13)19/h3-8H,2,9H2,1H3,(H,20,21)
InChIKeyUVKYTUZBRUOOIX-UHFFFAOYSA-N
MW309.29 g/mol
LogP3.68
Rot. Bonds5

About 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide

2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide (PubChem CID 9095297) has the molecular formula C16H14F3NO2 and a molecular weight of 309.29 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide
PubChem CID9095297
Molecular FormulaC16H14F3NO2
Molecular Weight309.29 g/mol
Exact Mass309.10
IUPAC Name2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ccc(F)c(F)c2F)cc1
InChIInChI=1S/C16H14F3NO2/c1-2-10-3-5-11(6-4-10)22-9-14(21)20-13-8-7-12(17)15(18)16(13)19/h3-8H,2,9H2,1H3,(H,20,21)
InChIKeyUVKYTUZBRUOOIX-UHFFFAOYSA-N
XLogP3.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.29
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)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-(4-bromophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
CID 2631889
1-[2-(4-ethylphenoxy)ethyl]-3-(2,3,4-trifluorophenyl)urea
CID 112972178
2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 804157
2-[4-(butylsulfamoyl)phenoxy]-N-(2,3,4-trifluorophenyl)acetamide
CID 28554061
N-(4-ethylphenyl)-2-(4-fluorophenoxy)acetamide
CID 893586
2-[4-(1,3-dithian-2-yl)phenoxy]-N-(2,3,4-trifluorophenyl)acetamide
CID 55382041
2-[4-(2-methylpropylsulfamoyl)phenoxy]-N-(2,3,4-trifluorophenyl)acetamide
CID 28552672
2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
CID 2633081
N-(2,5-difluorophenyl)-2-(4-ethoxyphenoxy)acetamide
CID 16552755
[2-oxo-2-[[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]amino]ethyl] 4-ethylbenzoate
CID 7364824
2-(4-ethylphenoxy)-N-[4-iodo-2-(trifluoromethyl)phenyl]acetamide
CID 1293662
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 7936390

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide (CID 9095297) is 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide is CCc1ccc(OCC(=O)Nc2ccc(F)c(F)c2F)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
The InChIKey is UVKYTUZBRUOOIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO2/c1-2-10-3-5-11(6-4-10)22-9-14(21)20-13-8-7-12(17)15(18)16(13)19/h3-8H,2,9H2,1H3,(H,20,21).
What are the key properties of 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide has a molecular weight of 309.29 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide is sourced from PubChem (CID 9095297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).