2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide

C16H15F2NO2 — CID 16546160

IUPAC2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
SMILESCC(NC(=O)COc1ccccc1F)c1ccc(F)cc1
InChIInChI=1S/C16H15F2NO2/c1-11(12-6-8-13(17)9-7-12)19-16(20)10-21-15-5-3-2-4-14(15)18/h2-9,11H,10H2,1H3,(H,19,20)
InChIKeyQJVGXVJGRVDXRJ-UHFFFAOYSA-N
MW291.30 g/mol
LogP3.22
Rot. Bonds5

About 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide

2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide (PubChem CID 16546160) has the molecular formula C16H15F2NO2 and a molecular weight of 291.30 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
PubChem CID16546160
Molecular FormulaC16H15F2NO2
Molecular Weight291.30 g/mol
Exact Mass291.11
IUPAC Name2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
SMILESCC(NC(=O)COc1ccccc1F)c1ccc(F)cc1
InChIInChI=1S/C16H15F2NO2/c1-11(12-6-8-13(17)9-7-12)19-16(20)10-21-15-5-3-2-4-14(15)18/h2-9,11H,10H2,1H3,(H,19,20)
InChIKeyQJVGXVJGRVDXRJ-UHFFFAOYSA-N
XLogP3.22
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide (CID 16546160) is 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide is CC(NC(=O)COc1ccccc1F)c1ccc(F)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is QJVGXVJGRVDXRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO2/c1-11(12-6-8-13(17)9-7-12)19-16(20)10-21-15-5-3-2-4-14(15)18/h2-9,11H,10H2,1H3,(H,19,20).
What are the key properties of 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide?
2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 291.30 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 16546160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).