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N-[2-(dimethylamino)ethyl]-4-[[2-(2-naphthalenyloxy)ethyl]oxy]-alpha-oxobenzeneacetamide

HCID 19004527
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CN(C)CCNC(=O)C(=O)c1ccc(OCCOc2ccc3ccccc3c2)cc1
InChIKey
NXYKFRKCXIFPNN-UHFFFAOYSA-N
Molecular formula
C24H26N2O4
Average molar mass
406.5 g/mol
Monoisotopic mass
406.18925731

Names & identifiers

Preferred name
N-[2-(dimethylamino)ethyl]-4-[[2-(2-naphthalenyloxy)ethyl]oxy]-alpha-oxobenzeneacetamide
IUPAC
N-[2-(dimethylamino)ethyl]-2-[4-(2-naphthalen-2-yloxyethoxy)phenyl]-2-oxoacetamide

Names & synonyms

SCHEMBL9041275NXYKFRKCXIFPNN-UHFFFAOYSA-NN-[2-(dimethylamino)ethyl]-4-[[2-(2-naphthalenyloxy)ethyl]oxy]-alpha-oxobenzeneacetamide

Database identifiers

PubChem CID
19004527

Properties

Computed structural properties

XLogP
4
Topological polar surface area
67.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
30
Formal charge
0
Complexity
545

Related reactions

2 records
New reaction record
HRID 153419 reaction equation
HRID 153419As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 2225759 reaction equation
HRID 2225759As productuspto-grants-1994_09

Compound notes

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