N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide

C16H14F3NO2 — CID 110788270

IUPACN-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)NCCc1ccc(F)c(F)c1
InChIInChI=1S/C16H14F3NO2/c17-12-6-5-11(9-14(12)19)7-8-20-16(21)10-22-15-4-2-1-3-13(15)18/h1-6,9H,7-8,10H2,(H,20,21)
InChIKeyPHOMFONIFWNYLZ-UHFFFAOYSA-N
MW309.29 g/mol
LogP2.84
Rot. Bonds6

About N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide

N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide (PubChem CID 110788270) has the molecular formula C16H14F3NO2 and a molecular weight of 309.29 g/mol. Its IUPAC name is N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide
PubChem CID110788270
Molecular FormulaC16H14F3NO2
Molecular Weight309.29 g/mol
Exact Mass309.10
IUPAC NameN-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)NCCc1ccc(F)c(F)c1
InChIInChI=1S/C16H14F3NO2/c17-12-6-5-11(9-14(12)19)7-8-20-16(21)10-22-15-4-2-1-3-13(15)18/h1-6,9H,7-8,10H2,(H,20,21)
InChIKeyPHOMFONIFWNYLZ-UHFFFAOYSA-N
XLogP2.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.29
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)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-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 7700300
2-(2-fluorophenoxy)-N-[2-(3-hydroxyphenyl)ethyl]acetamide
CID 51098959
methyl 4-[2-[[2-(2-fluorophenoxy)acetyl]amino]ethyl]benzoate
CID 36775654
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-(2-fluorophenoxy)acetamide
CID 110792411
N-[2-(3,4-difluorophenyl)ethyl]-2-(3-fluorophenoxy)acetamide
CID 110788271
N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
CID 34315448
2-(2-fluorophenoxy)-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]acetamide
CID 110788485
N-[3-(3,4-dimethoxyphenyl)propyl]-2-(2-fluorophenoxy)acetamide
CID 48586236
[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-fluorophenoxy)acetate
CID 7842405
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 7700855
2-(2-fluorophenoxy)-N-[2-(1-methylpyrrol-3-yl)ethyl]acetamide
CID 110789233
2-(2-fluorophenoxy)-N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]acetamide
CID 110788587

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide (CID 110788270) is N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide is O=C(COc1ccccc1F)NCCc1ccc(F)c(F)c1.
What is the InChIKey of N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide?
The InChIKey is PHOMFONIFWNYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO2/c17-12-6-5-11(9-14(12)19)7-8-20-16(21)10-22-15-4-2-1-3-13(15)18/h1-6,9H,7-8,10H2,(H,20,21).
What are the key properties of N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide?
N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide has a molecular weight of 309.29 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 110788270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).