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N-[3-(cyclohexen-1-yl)phenyl]-4-hydroxy-3-methoxyphenylacetamide

HCID 22019669
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COc1cc(CC(=O)Nc2cccc(C3=CCCCC3)c2)ccc1O
InChIKey
OWDHOAPTHIIBDW-UHFFFAOYSA-N
Molecular formula
C21H23NO3
Average molar mass
337.4 g/mol

Names & identifiers

Preferred name
N-[3-(cyclohexen-1-yl)phenyl]-4-hydroxy-3-methoxyphenylacetamide
IUPAC
N-[3-(cyclohexen-1-yl)phenyl]-2-(4-hydroxy-3-methoxyphenyl)acetamide

Names & synonyms

SCHEMBL6100782OWDHOAPTHIIBDW-UHFFFAOYSA-NN-[3-(cyclohexen-1-yl)phenyl]-4-hydroxy-3-methoxyphenylacetamide

Database identifiers

PubChem CID
22019669

Properties

Computed structural properties

XLogP
4
Topological polar surface area
58.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
476

Related reactions

2 records
New reaction record
HRID 7062 reaction equation
HRID 7062As productuspto-grants-2006_08
HRID 1212489 reaction equation
HRID 1212489As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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