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3-(2-fluorophenyl)-N-[1-[3-[(6-methyl-3-pyridinyl)oxy]phenyl]ethyl]prop-2-enamide

HCID 69796643
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1ccc(Oc2cccc(C(C)NC(=O)C=Cc3ccccc3F)c2)cn1
InChIKey
IRDRUCRDBDLWOK-UHFFFAOYSA-N
Molecular formula
C23H21FN2O2
Average molar mass
376.4 g/mol
Monoisotopic mass
376.15870608

Names & identifiers

Preferred name
3-(2-fluorophenyl)-N-[1-[3-[(6-methyl-3-pyridinyl)oxy]phenyl]ethyl]prop-2-enamide
IUPAC
3-(2-fluorophenyl)-N-[1-[3-[(6-methyl-3-pyridinyl)oxy]phenyl]ethyl]prop-2-enamide

Names & synonyms

SCHEMBL6484865

Database identifiers

PubChem CID
69796643

Properties

Computed structural propertiesFilling in

XLogP
4.5
Topological polar surface area
51.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
28
Formal charge
0
Complexity
527

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Related reactions

1 records
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HRID 674308 reaction equation
HRID 674308As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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