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

C19H22FNO4 — CID 90622981

IUPAC2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
SMILESCCOc1ccc(OCC(=O)NCC(OC)c2cccc(F)c2)cc1
InChIInChI=1S/C19H22FNO4/c1-3-24-16-7-9-17(10-8-16)25-13-19(22)21-12-18(23-2)14-5-4-6-15(20)11-14/h4-11,18H,3,12-13H2,1-2H3,(H,21,22)
InChIKeyYBRQGKYNKBFJCC-UHFFFAOYSA-N
MW347.39 g/mol
LogP3.11
Rot. Bonds9

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

2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide (PubChem CID 90622981) has the molecular formula C19H22FNO4 and a molecular weight of 347.39 g/mol. Its IUPAC name is 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
PubChem CID90622981
Molecular FormulaC19H22FNO4
Molecular Weight347.39 g/mol
Exact Mass347.15
IUPAC Name2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide
SMILESCCOc1ccc(OCC(=O)NCC(OC)c2cccc(F)c2)cc1
InChIInChI=1S/C19H22FNO4/c1-3-24-16-7-9-17(10-8-16)25-13-19(22)21-12-18(23-2)14-5-4-6-15(20)11-14/h4-11,18H,3,12-13H2,1-2H3,(H,21,22)
InChIKeyYBRQGKYNKBFJCC-UHFFFAOYSA-N
XLogP3.11
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.39
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-fluorophenyl)-2-methoxyethyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 90622980
2-(4-fluorophenoxy)-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]acetamide
CID 90623316
N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide
CID 90622906
N-[2-(3-fluorophenyl)-2-methoxyethyl]-2-methylpropanamide
CID 90622872
2-(4-chlorophenoxy)-N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]acetamide
CID 43017004
N-[(4-ethoxyphenyl)methyl]-2-(3-fluorophenoxy)acetamide
CID 110780897
N-[2-[[2-(4-ethoxyphenoxy)acetyl]amino]ethyl]-3-fluorobenzamide
CID 108542788
1-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylurea
CID 90623219
N'-[2-(3-fluorophenyl)-2-methoxyethyl]-N-(2-methoxyethyl)oxamide
CID 90623137
N-[(2R)-2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2-(3,4-dimethylphenoxy)acetamide
CID 30525493
N-(2-amino-2-phenylethyl)-2-(4-ethoxyphenoxy)acetamide;hydrochloride
CID 119528609
1-[2-(3-fluorophenyl)-2-methoxyethyl]-3-(4-methylphenyl)urea
CID 90623223

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
The IUPAC name of 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide (CID 90622981) is 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide.
What is the SMILES notation for 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
The canonical SMILES for 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide is CCOc1ccc(OCC(=O)NCC(OC)c2cccc(F)c2)cc1.
What is the InChIKey of 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
The InChIKey is YBRQGKYNKBFJCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO4/c1-3-24-16-7-9-17(10-8-16)25-13-19(22)21-12-18(23-2)14-5-4-6-15(20)11-14/h4-11,18H,3,12-13H2,1-2H3,(H,21,22).
What are the key properties of 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide?
2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide has a molecular weight of 347.39 g/mol, XLogP of 3.11, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenoxy)-N-[2-(3-fluorophenyl)-2-methoxyethyl]acetamide is sourced from PubChem (CID 90622981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).