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alpha-Hydroxy-beta-Phenoxy-N-(1-Methylethyl)Benzenepropanamide

HCID 13041337
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)NC(=O)C(O)C(Oc1ccccc1)c1ccccc1
InChIKey
IFWQXCIRELXYMI-UHFFFAOYSA-N
Molecular formula
C18H21NO3
Average molar mass
299.4 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL11187618IFWQXCIRELXYMI-UHFFFAOYSA-Nalpha-Hydroxy-beta-Phenoxy-N-(1-Methylethyl)Benzenepropanamide

Database identifiers

PubChem CID
13041337

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
58.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
333

Related reactions

6 records
New reaction record
HRID 173326 reaction equation
HRID 173326As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 435494 reaction equation
HRID 435494As productuspto-grants-1983_08
HRID 435505 reaction equation
HRID 435505As reactantuspto-grants-1983_08
HRID 1221771 reaction equation
HRID 1221771As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1759522 reaction equation
HRID 1759522As productuspto-grants-1982_07
HRID 1759533 reaction equation
HRID 1759533As reactantuspto-grants-1982_07

Compound notes

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