2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide

C22H18F3NO2 — CID 8871382

IUPAC2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)NCc1cccc(C(F)(F)F)c1
InChIInChI=1S/C22H18F3NO2/c23-22(24,25)18-10-6-7-16(13-18)14-26-21(27)15-28-20-12-5-4-11-19(20)17-8-2-1-3-9-17/h1-13H,14-15H2,(H,26,27)
InChIKeyZUIOHCABWGSKBO-UHFFFAOYSA-N
MW385.39 g/mol
LogP5.07
Rot. Bonds6

About 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide

2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide (PubChem CID 8871382) has the molecular formula C22H18F3NO2 and a molecular weight of 385.39 g/mol. Its IUPAC name is 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
PubChem CID8871382
Molecular FormulaC22H18F3NO2
Molecular Weight385.39 g/mol
Exact Mass385.13
IUPAC Name2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)NCc1cccc(C(F)(F)F)c1
InChIInChI=1S/C22H18F3NO2/c23-22(24,25)18-10-6-7-16(13-18)14-26-21(27)15-28-20-12-5-4-11-19(20)17-8-2-1-3-9-17/h1-13H,14-15H2,(H,26,27)
InChIKeyZUIOHCABWGSKBO-UHFFFAOYSA-N
XLogP5.07
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.39
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 8871375
2-(4-bromo-2-fluorophenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 26241530
2-[3-(trifluoromethyl)phenyl]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 26241577
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 5217542
2-(2-aminoethoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 79463391
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
CID 55340991
2-(2-methoxy-4-prop-2-enylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide
CID 18084109
2-(2-phenylphenoxy)-N-[(Z)-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylideneamino]acetamide
CID 50929981
2-[2-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]sulfonylacetic acid
CID 3767269
N-[2-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]benzamide
CID 26887208
N-benzyl-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 20939884
[2-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl] 2-methylbenzoate
CID 46860424

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide (CID 8871382) is 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide is O=C(COc1ccccc1-c1ccccc1)NCc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide?
The InChIKey is ZUIOHCABWGSKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18F3NO2/c23-22(24,25)18-10-6-7-16(13-18)14-26-21(27)15-28-20-12-5-4-11-19(20)17-8-2-1-3-9-17/h1-13H,14-15H2,(H,26,27).
What are the key properties of 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide?
2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide has a molecular weight of 385.39 g/mol, XLogP of 5.07, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 8871382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).