2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide

C19H20FNO4 — CID 9201182

IUPAC2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide
SMILESCCOc1cc(C=O)ccc1OCC(=O)NCCc1ccccc1F
InChIInChI=1S/C19H20FNO4/c1-2-24-18-11-14(12-22)7-8-17(18)25-13-19(23)21-10-9-15-5-3-4-6-16(15)20/h3-8,11-12H,2,9-10,13H2,1H3,(H,21,23)
InChIKeyLWCQCJLRYORTGP-UHFFFAOYSA-N
MW345.37 g/mol
LogP2.77
Rot. Bonds9

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

2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide (PubChem CID 9201182) has the molecular formula C19H20FNO4 and a molecular weight of 345.37 g/mol. Its IUPAC name is 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide
PubChem CID9201182
Molecular FormulaC19H20FNO4
Molecular Weight345.37 g/mol
Exact Mass345.14
IUPAC Name2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide
SMILESCCOc1cc(C=O)ccc1OCC(=O)NCCc1ccccc1F
InChIInChI=1S/C19H20FNO4/c1-2-24-18-11-14(12-22)7-8-17(18)25-13-19(23)21-10-9-15-5-3-4-6-16(15)20/h3-8,11-12H,2,9-10,13H2,1H3,(H,21,23)
InChIKeyLWCQCJLRYORTGP-UHFFFAOYSA-N
XLogP2.77
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.37
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2-ethoxy-4-formylphenoxy)-N-ethylacetamide
CID 2110936
2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxyethyl)acetamide
CID 35721007
2-[[2-(2-ethoxy-4-formylphenoxy)acetyl]amino]-N-propylacetamide
CID 9201158
2-(2-ethoxy-4-formylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7820624
2-(2-ethoxy-4-formylphenoxy)-N-phenylacetamide
CID 844203
2-[[2-(2-ethoxy-4-formylphenoxy)acetyl]amino]-N-ethylacetamide
CID 9201164
N-tert-butyl-2-[2-ethoxy-4-[[2-(2-fluorophenyl)ethylamino]methyl]phenoxy]acetamide;hydrochloride
CID 17293185
N-[2-(4-ethoxyphenoxy)ethyl]-2-(4-formyl-2-methoxyphenoxy)acetamide
CID 34060908
2-(2-ethoxy-4-formylphenoxy)-N-(3-fluorophenyl)acetamide
CID 8009500
1-[(2-ethoxyphenoxy)methyl]-3-[2-(2-fluorophenyl)ethyl]urea
CID 108877434
2-(2-ethoxy-4-formylphenoxy)-N-(2-fluoro-5-methylphenyl)acetamide
CID 6457252
N-[2-(2-fluorophenyl)ethyl]-2-[[2-(2-methoxyphenoxy)acetyl]amino]acetamide
CID 112993325

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide (CID 9201182) is 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide is CCOc1cc(C=O)ccc1OCC(=O)NCCc1ccccc1F.
What is the InChIKey of 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide?
The InChIKey is LWCQCJLRYORTGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO4/c1-2-24-18-11-14(12-22)7-8-17(18)25-13-19(23)21-10-9-15-5-3-4-6-16(15)20/h3-8,11-12H,2,9-10,13H2,1H3,(H,21,23).
What are the key properties of 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide?
2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide has a molecular weight of 345.37 g/mol, XLogP of 2.77, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxy-4-formylphenoxy)-N-[2-(2-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 9201182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).