2-(2-ethoxy-4-formylphenoxy)acetamide

C11H13NO4 — CID 874614

IUPAC2-(2-ethoxy-4-formylphenoxy)acetamide
SMILESCCOc1cc(C=O)ccc1OCC(N)=O
InChIInChI=1S/C11H13NO4/c1-2-15-10-5-8(6-13)3-4-9(10)16-7-11(12)14/h3-6H,2,7H2,1H3,(H2,12,14)
InChIKeySVAIFXRICURVNE-UHFFFAOYSA-N
MW223.23 g/mol
LogP0.76
Rot. Bonds6

About 2-(2-ethoxy-4-formylphenoxy)acetamide

2-(2-ethoxy-4-formylphenoxy)acetamide (PubChem CID 874614) has the molecular formula C11H13NO4 and a molecular weight of 223.23 g/mol. Its IUPAC name is 2-(2-ethoxy-4-formylphenoxy)acetamide.

Molecular Properties

Compound Name2-(2-ethoxy-4-formylphenoxy)acetamide
PubChem CID874614
Molecular FormulaC11H13NO4
Molecular Weight223.23 g/mol
Exact Mass223.08
IUPAC Name2-(2-ethoxy-4-formylphenoxy)acetamide
SMILESCCOc1cc(C=O)ccc1OCC(N)=O
InChIInChI=1S/C11H13NO4/c1-2-15-10-5-8(6-13)3-4-9(10)16-7-11(12)14/h3-6H,2,7H2,1H3,(H2,12,14)
InChIKeySVAIFXRICURVNE-UHFFFAOYSA-N
XLogP0.76
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxy-4-formylphenoxy)acetamide?
The IUPAC name of 2-(2-ethoxy-4-formylphenoxy)acetamide (CID 874614) is 2-(2-ethoxy-4-formylphenoxy)acetamide.
What is the SMILES notation for 2-(2-ethoxy-4-formylphenoxy)acetamide?
The canonical SMILES for 2-(2-ethoxy-4-formylphenoxy)acetamide is CCOc1cc(C=O)ccc1OCC(N)=O.
What is the InChIKey of 2-(2-ethoxy-4-formylphenoxy)acetamide?
The InChIKey is SVAIFXRICURVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO4/c1-2-15-10-5-8(6-13)3-4-9(10)16-7-11(12)14/h3-6H,2,7H2,1H3,(H2,12,14).
What are the key properties of 2-(2-ethoxy-4-formylphenoxy)acetamide?
2-(2-ethoxy-4-formylphenoxy)acetamide has a molecular weight of 223.23 g/mol, XLogP of 0.76, 6 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)acetamide is sourced from PubChem (CID 874614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).