2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide

C22H28N2O6 — CID 101189832

IUPAC2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)COCCOCC(=O)Nc2ccc(OCC)cc2)cc1
InChIInChI=1S/C22H28N2O6/c1-3-29-19-9-5-17(6-10-19)23-21(25)15-27-13-14-28-16-22(26)24-18-7-11-20(12-8-18)30-4-2/h5-12H,3-4,13-16H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyNKCSODREGDHKQA-UHFFFAOYSA-N
MW416.47 g/mol
LogP3.09
Rot. Bonds13

About 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide

2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide (PubChem CID 101189832) has the molecular formula C22H28N2O6 and a molecular weight of 416.47 g/mol. Its IUPAC name is 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide
PubChem CID101189832
Molecular FormulaC22H28N2O6
Molecular Weight416.47 g/mol
Exact Mass416.19
IUPAC Name2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)COCCOCC(=O)Nc2ccc(OCC)cc2)cc1
InChIInChI=1S/C22H28N2O6/c1-3-29-19-9-5-17(6-10-19)23-21(25)15-27-13-14-28-16-22(26)24-18-7-11-20(12-8-18)30-4-2/h5-12H,3-4,13-16H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyNKCSODREGDHKQA-UHFFFAOYSA-N
XLogP3.09
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.47
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 60758701
2-(4-ethoxyphenoxy)-N-(4-propan-2-yloxyphenyl)acetamide
CID 19177758
N-(4-ethoxyphenyl)-2-(4-propanoylphenoxy)acetamide
CID 2542308
N,N'-bis(4-ethoxyphenyl)nonanediamide
CID 4507995
2-[4-(2-ethoxyethoxy)phenoxy]-N-(4-fluorophenyl)acetamide
CID 4732952
2-(2-methoxyethoxy)-N-[4-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 103606770
[2-(4-ethoxyanilino)-2-oxoethyl] 4-propoxybenzoate
CID 7211928
N-(4-ethoxyphenyl)-N'-(4-fluorophenyl)propanediamide
CID 108954809
2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
CID 2268503
N-(4-bromophenyl)-2-(4-ethoxyphenyl)acetamide
CID 8719858
methyl 2-[4-[2-(4-ethoxyanilino)-2-oxoethoxy]phenyl]acetate
CID 7695236
N-(4-ethoxyphenyl)-3-hydroxybutanamide
CID 14130

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide?
The IUPAC name of 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide (CID 101189832) is 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide is CCOc1ccc(NC(=O)COCCOCC(=O)Nc2ccc(OCC)cc2)cc1.
What is the InChIKey of 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide?
The InChIKey is NKCSODREGDHKQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O6/c1-3-29-19-9-5-17(6-10-19)23-21(25)15-27-13-14-28-16-22(26)24-18-7-11-20(12-8-18)30-4-2/h5-12H,3-4,13-16H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide?
2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide has a molecular weight of 416.47 g/mol, XLogP of 3.09, 13 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 101189832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).