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2-[4-(3-fluoro-benzyloxy)-phenoxy]-N-methyl-acetamide

HCID 11601710
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CNC(=O)COc1ccc(OCc2cccc(F)c2)cc1
InChIKey
WQNLSIYVAJCTDC-UHFFFAOYSA-N
Molecular formula
C16H16FNO3
Average molar mass
289.3 g/mol

Names & identifiers

Preferred name
2-[4-(3-fluoro-benzyloxy)-phenoxy]-N-methyl-acetamide
IUPAC
2-[4-[(3-fluorophenyl)methoxy]phenoxy]-N-methylacetamide

Names & synonyms

SCHEMBL4428763WQNLSIYVAJCTDC-UHFFFAOYSA-N2-[4-(3-fluoro-benzyloxy)-phenoxy]-N-methyl-acetamide

Database identifiers

PubChem CID
11601710

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
47.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
319

Related reactions

2 records
New reaction record
HRID 853152 reaction equation
HRID 853152As productuspto-grants-2007_08
HRID 1230319 reaction equation
HRID 1230319As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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