2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide

C21H24N2O5 — CID 9076521

IUPAC2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)C(=O)COc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H24N2O5/c1-23(14-19(24)22-12-13-27-2)20(25)15-28-18-10-8-17(9-11-18)21(26)16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,22,24)
InChIKeyNEOACFKYDSVSRA-UHFFFAOYSA-N
MW384.43 g/mol
LogP1.52
Rot. Bonds10

About 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide

2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide (PubChem CID 9076521) has the molecular formula C21H24N2O5 and a molecular weight of 384.43 g/mol. Its IUPAC name is 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide
PubChem CID9076521
Molecular FormulaC21H24N2O5
Molecular Weight384.43 g/mol
Exact Mass384.17
IUPAC Name2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)C(=O)COc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H24N2O5/c1-23(14-19(24)22-12-13-27-2)20(25)15-28-18-10-8-17(9-11-18)21(26)16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,22,24)
InChIKeyNEOACFKYDSVSRA-UHFFFAOYSA-N
XLogP1.52
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]acetamide
CID 56809046
N-[2-(2-methoxyethylamino)-2-oxoethyl]-N-methylnaphthalene-2-carboxamide
CID 9076484
3-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-2-methylpropanoic acid
CID 122111906
2-(4-benzoylphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 7560002
2-(4-benzoylphenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 2457089
2-(4-hydroxyphenoxy)-N-(2-methoxyethyl)acetamide
CID 61485470
2-[4-(4-chlorobenzoyl)phenoxy]-N-(3-methoxypropyl)acetamide
CID 51141743
2-[[2-(4-benzoylphenoxy)acetyl]amino]ethyl-diethylazanium
CID 9315010
[2-oxo-2-(2-phenoxyethylamino)ethyl] 4-benzoylbenzoate
CID 8534586
3-chloro-4-iodo-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N-methylbenzamide
CID 103734742
2-[[2-(4-benzoylphenoxy)acetyl]-ethylamino]-N-propan-2-ylacetamide
CID 3577124
2-(4-benzoylphenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylacetamide
CID 24979721

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide (CID 9076521) is 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(C)C(=O)COc1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide?
The InChIKey is NEOACFKYDSVSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O5/c1-23(14-19(24)22-12-13-27-2)20(25)15-28-18-10-8-17(9-11-18)21(26)16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,22,24).
What are the key properties of 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide?
2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide has a molecular weight of 384.43 g/mol, XLogP of 1.52, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 9076521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).