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

C16H15F2NO2 — CID 7700300

IUPAC2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
SMILESO=C(COc1ccccc1F)NCCc1ccc(F)cc1
InChIInChI=1S/C16H15F2NO2/c17-13-7-5-12(6-8-13)9-10-19-16(20)11-21-15-4-2-1-3-14(15)18/h1-8H,9-11H2,(H,19,20)
InChIKeyBAINJTZJFHNSOU-UHFFFAOYSA-N
MW291.30 g/mol
LogP2.70
Rot. Bonds6

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

2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide (PubChem CID 7700300) has the molecular formula C16H15F2NO2 and a molecular weight of 291.30 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
PubChem CID7700300
Molecular FormulaC16H15F2NO2
Molecular Weight291.30 g/mol
Exact Mass291.11
IUPAC Name2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
SMILESO=C(COc1ccccc1F)NCCc1ccc(F)cc1
InChIInChI=1S/C16H15F2NO2/c17-13-7-5-12(6-8-13)9-10-19-16(20)11-21-15-4-2-1-3-14(15)18/h1-8H,9-11H2,(H,19,20)
InChIKeyBAINJTZJFHNSOU-UHFFFAOYSA-N
XLogP2.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 52.70
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-[2-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide (CID 7700300) is 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide is O=C(COc1ccccc1F)NCCc1ccc(F)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is BAINJTZJFHNSOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO2/c17-13-7-5-12(6-8-13)9-10-19-16(20)11-21-15-4-2-1-3-14(15)18/h1-8H,9-11H2,(H,19,20).
What are the key properties of 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide?
2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 291.30 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 7700300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).