2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide

C23H22FNO4 — CID 55577983

IUPAC2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide
SMILESCCOc1ccccc1OCC(=O)Nc1cccc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C23H22FNO4/c1-2-27-21-8-3-4-9-22(21)29-16-23(26)25-19-6-5-7-20(14-19)28-15-17-10-12-18(24)13-11-17/h3-14H,2,15-16H2,1H3,(H,25,26)
InChIKeyDZZGXARNYPPWOC-UHFFFAOYSA-N
MW395.43 g/mol
LogP4.82
Rot. Bonds9

About 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide

2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide (PubChem CID 55577983) has the molecular formula C23H22FNO4 and a molecular weight of 395.43 g/mol. Its IUPAC name is 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide
PubChem CID55577983
Molecular FormulaC23H22FNO4
Molecular Weight395.43 g/mol
Exact Mass395.15
IUPAC Name2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide
SMILESCCOc1ccccc1OCC(=O)Nc1cccc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C23H22FNO4/c1-2-27-21-8-3-4-9-22(21)29-16-23(26)25-19-6-5-7-20(14-19)28-15-17-10-12-18(24)13-11-17/h3-14H,2,15-16H2,1H3,(H,25,26)
InChIKeyDZZGXARNYPPWOC-UHFFFAOYSA-N
XLogP4.82
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.43
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide?
The IUPAC name of 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide (CID 55577983) is 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide.
What is the SMILES notation for 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide?
The canonical SMILES for 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide is CCOc1ccccc1OCC(=O)Nc1cccc(OCc2ccc(F)cc2)c1.
What is the InChIKey of 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide?
The InChIKey is DZZGXARNYPPWOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FNO4/c1-2-27-21-8-3-4-9-22(21)29-16-23(26)25-19-6-5-7-20(14-19)28-15-17-10-12-18(24)13-11-17/h3-14H,2,15-16H2,1H3,(H,25,26).
What are the key properties of 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide?
2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide has a molecular weight of 395.43 g/mol, XLogP of 4.82, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenoxy)-N-[3-[(4-fluorophenyl)methoxy]phenyl]acetamide is sourced from PubChem (CID 55577983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).