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2-(2-Fluoro-4-methylphenylamino)-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid methyl ester

HCID 59843571
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1ccc(=O)n(C)c1Nc1ccc(C)cc1F
InChIKey
WNXQPNMMWVQJDY-UHFFFAOYSA-N
Molecular formula
C15H15FN2O3
Average molar mass
290.29 g/mol

Names & identifiers

Preferred name
2-(2-Fluoro-4-methylphenylamino)-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid methyl ester
IUPAC
methyl 2-(2-fluoro-4-methylanilino)-1-methyl-6-oxopyridine-3-carboxylate

Names & synonyms

SCHEMBL391338WNXQPNMMWVQJDY-UHFFFAOYSA-N2-(2-fluoro-4-methylphenylamino)-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid methyl ester

Database identifiers

PubChem CID
59843571

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
58.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
501

Related reactions

11 records
New reaction record
HRID 15940 reaction equation
HRID 15940As reactantuspto-grants-2010_06
HRID 421882 reaction equation
HRID 421882As reactantuspto-grants-2012_01
HRID 422790 reaction equation
HRID 422790As reactantuspto-grants-2012_01
HRID 1236656 reaction equation
HRID 1236656As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1366078 reaction equation
HRID 1366078As reactantuspto-grants-2011_02
HRID 1510502 reaction equation
HRID 1510502As reactantuspto-grants-2012_07
HRID 1510575 reaction equation
HRID 1510575As reactantuspto-grants-2012_07
HRID 1817967 reaction equation
HRID 1817967As reactantuspto-grants-2009_10
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Compound notes

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