2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide

C21H28N2O4 — CID 54827535

IUPAC2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNc2ccccc2OCCOCC)cc1
InChIInChI=1S/C21H28N2O4/c1-3-13-26-18-11-9-17(10-12-18)23-21(24)16-22-19-7-5-6-8-20(19)27-15-14-25-4-2/h5-12,22H,3-4,13-16H2,1-2H3,(H,23,24)
InChIKeyYSIXZPIVEHAHST-UHFFFAOYSA-N
MW372.47 g/mol
LogP3.94
Rot. Bonds12

About 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide

2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide (PubChem CID 54827535) has the molecular formula C21H28N2O4 and a molecular weight of 372.47 g/mol. Its IUPAC name is 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide
PubChem CID54827535
Molecular FormulaC21H28N2O4
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNc2ccccc2OCCOCC)cc1
InChIInChI=1S/C21H28N2O4/c1-3-13-26-18-11-9-17(10-12-18)23-21(24)16-22-19-7-5-6-8-20(19)27-15-14-25-4-2/h5-12,22H,3-4,13-16H2,1-2H3,(H,23,24)
InChIKeyYSIXZPIVEHAHST-UHFFFAOYSA-N
XLogP3.94
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(4-butoxyphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827505
2-(2-butoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54828232
2-[2-(2-ethoxyethoxy)anilino]-N-[4-(3-phenylpropoxy)phenyl]acetamide
CID 54827411
N-[4-[[2-[2-(2-ethoxyethoxy)anilino]acetyl]amino]phenyl]-2-methylpropanamide
CID 54827316
N-[2-(2-phenoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820282
2-(4-butoxyanilino)-N-[4-(2-ethoxyethoxy)phenyl]acetamide
CID 54820258
2-[2-(2-ethoxyethoxy)anilino]-N-(3-heptoxyphenyl)acetamide
CID 54827601
2-(2-butoxyanilino)-N-[4-(3-methylbutoxy)phenyl]acetamide
CID 54827745
N-(3,5-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827277
N-[4-(2-ethoxyethoxy)phenyl]-2-[3-(2-phenoxyethoxy)anilino]acetamide
CID 54825982
N-[4-[[2-[4-(2-ethoxyethoxy)anilino]-2-oxoethyl]amino]phenyl]butanamide
CID 54837207
2-(2-methoxyanilino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54817190

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide?
The IUPAC name of 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide (CID 54827535) is 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide?
The canonical SMILES for 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide is CCCOc1ccc(NC(=O)CNc2ccccc2OCCOCC)cc1.
What is the InChIKey of 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide?
The InChIKey is YSIXZPIVEHAHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O4/c1-3-13-26-18-11-9-17(10-12-18)23-21(24)16-22-19-7-5-6-8-20(19)27-15-14-25-4-2/h5-12,22H,3-4,13-16H2,1-2H3,(H,23,24).
What are the key properties of 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide?
2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide has a molecular weight of 372.47 g/mol, XLogP of 3.94, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyethoxy)anilino]-N-(4-propoxyphenyl)acetamide is sourced from PubChem (CID 54827535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).