2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide

C16H14F3NO2 — CID 130158368

IUPAC2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide
SMILESO=C(NCc1ccccc1OCc1ccccc1)C(F)(F)F
InChIInChI=1S/C16H14F3NO2/c17-16(18,19)15(21)20-10-13-8-4-5-9-14(13)22-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)
InChIKeyUCPUNYVLTYODKT-UHFFFAOYSA-N
MW309.29 g/mol
LogP3.44
Rot. Bonds5

About 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide

2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide (PubChem CID 130158368) has the molecular formula C16H14F3NO2 and a molecular weight of 309.29 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide
PubChem CID130158368
Molecular FormulaC16H14F3NO2
Molecular Weight309.29 g/mol
Exact Mass309.10
IUPAC Name2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide
SMILESO=C(NCc1ccccc1OCc1ccccc1)C(F)(F)F
InChIInChI=1S/C16H14F3NO2/c17-16(18,19)15(21)20-10-13-8-4-5-9-14(13)22-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)
InChIKeyUCPUNYVLTYODKT-UHFFFAOYSA-N
XLogP3.44
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 ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]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

N-[(2-phenylmethoxyphenyl)methyl]-2-propan-2-ylsulfonylpropanamide
CID 51123622
(2S)-2-amino-3-methyl-N-[(2-phenylmethoxyphenyl)methyl]butanamide;hydrochloride
CID 119296786
4-[[2-(anilinomethyl)phenoxy]methyl]benzoic acid
CID 126125704
N-[(2-phenylmethoxyphenyl)methyl]-1,2,5-thiadiazole-3-carboxamide
CID 87040886
2-methyl-2-[(2-phenylmethoxyphenyl)methylamino]propan-1-ol
CID 834073
N-[[2-(phenylmethoxymethyl)phenyl]methyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 46465102
4-[[[2-[(4-fluorophenyl)methoxy]phenyl]methylamino]methyl]benzoic acid;hydrochloride
CID 17294879
N-[(2-phenylmethoxyphenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119736957
(2,3,4,5,6-pentafluorophenyl) 2-(2-phenylmethoxyphenyl)acetate
CID 87805473
3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[(2-phenylmethoxyphenyl)methyl]propanamide
CID 55806270
1-methyl-2-oxo-N-[(2-phenylmethoxyphenyl)methyl]pyridine-4-carboxamide
CID 75461382
2-amino-2-(oxan-4-yl)-N-[(2-phenylmethoxyphenyl)methyl]acetamide
CID 120788670

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide (CID 130158368) is 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide is O=C(NCc1ccccc1OCc1ccccc1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide?
The InChIKey is UCPUNYVLTYODKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO2/c17-16(18,19)15(21)20-10-13-8-4-5-9-14(13)22-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21).
What are the key properties of 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide?
2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide has a molecular weight of 309.29 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[(2-phenylmethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 130158368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).