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2,6-dichloro-N-(3-fluorobenzyl)-4-methyl-pyridine-3-carboxylic acid amide

HCID 86664313
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1cc(Cl)nc(Cl)c1C(=O)NCc1cccc(F)c1
InChIKey
JJFUTPOCMMTPLC-UHFFFAOYSA-N
Molecular formula
C14H11Cl2FN2O
Average molar mass
313.2 g/mol

Names & identifiers

Preferred name
2,6-dichloro-N-(3-fluorobenzyl)-4-methyl-pyridine-3-carboxylic acid amide
IUPAC
2,6-dichloro-N-[(3-fluorophenyl)methyl]-4-methylpyridine-3-carboxamide

Names & synonyms

SCHEMBL2129852JJFUTPOCMMTPLC-UHFFFAOYSA-N2,6-dichloro-N-(3-fluorobenzyl)-4-methyl-pyridine-3-carboxylic acid amide

Database identifiers

PubChem CID
86664313

Properties

Computed structural properties

XLogP
4
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
345

Related reactions

23 records
New reaction record
HRID 92400 reaction equation
HRID 92400As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 204761 reaction equation
HRID 204761As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 290365 reaction equation
HRID 290365As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 922010 reaction equation
HRID 922010As productuspto-grants-2016_03
HRID 922019 reaction equation
HRID 922019As reactantuspto-grants-2016_03
HRID 922028 reaction equation
HRID 922028As reactantuspto-grants-2016_03
HRID 922030 reaction equation
HRID 922030As reactantuspto-grants-2016_03
HRID 922047 reaction equation
HRID 922047As reactantuspto-grants-2016_03
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Compound notes

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