2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide

C19H23NO4 — CID 3647692

IUPAC2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
SMILESCCc1ccc(OCC(=O)NCCOc2ccccc2OC)cc1
InChIInChI=1S/C19H23NO4/c1-3-15-8-10-16(11-9-15)24-14-19(21)20-12-13-23-18-7-5-4-6-17(18)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21)
InChIKeyJENFKGDBNVJTHF-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.83
Rot. Bonds9

About 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide

2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide (PubChem CID 3647692) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
PubChem CID3647692
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
SMILESCCc1ccc(OCC(=O)NCCOc2ccccc2OC)cc1
InChIInChI=1S/C19H23NO4/c1-3-15-8-10-16(11-9-15)24-14-19(21)20-12-13-23-18-7-5-4-6-17(18)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21)
InChIKeyJENFKGDBNVJTHF-UHFFFAOYSA-N
XLogP2.83
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide (CID 3647692) is 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide is CCc1ccc(OCC(=O)NCCOc2ccccc2OC)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide?
The InChIKey is JENFKGDBNVJTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-3-15-8-10-16(11-9-15)24-14-19(21)20-12-13-23-18-7-5-4-6-17(18)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21).
What are the key properties of 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide?
2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide has a molecular weight of 329.40 g/mol, XLogP of 2.83, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide is sourced from PubChem (CID 3647692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).