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alpha-Hydroxy-beta-(3-Methylphenoxy)-N-(1-Methylethyl)Benzenepropanamide

HCID 13041341
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1cccc(OC(c2ccccc2)C(O)C(=O)NC(C)C)c1
InChIKey
GRKXJMUQKVRDJW-UHFFFAOYSA-N
Molecular formula
C19H23NO3
Average molar mass
313.4 g/mol

Names & identifiers

Preferred name
alpha-Hydroxy-beta-(3-Methylphenoxy)-N-(1-Methylethyl)Benzenepropanamide
IUPAC
2-hydroxy-3-(3-methylphenoxy)-3-phenyl-N-propan-2-ylpropanamide

Names & synonyms

SCHEMBL11187111GRKXJMUQKVRDJW-UHFFFAOYSA-Nalpha-Hydroxy-beta-(3-Methylphenoxy)-N-(1-Methyethyl)Benzenepropanamidealpha-Hydroxy-beta-(3-Methylphenoxy)-N-(1-Methylethyl)Benzenepropanamide

Database identifiers

PubChem CID
13041341

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
58.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
23
Formal charge
0
Complexity
366

Related reactions

3 records
New reaction record
HRID 287769 reaction equation
HRID 287769As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 435497 reaction equation
HRID 435497As productuspto-grants-1983_08
HRID 1759525 reaction equation
HRID 1759525As productuspto-grants-1982_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes