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5,6-Dichloro-N-ethylnicotinamide

HCID 20120133
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCNC(=O)c1cnc(Cl)c(Cl)c1
InChIKey
GAIXUJQSFWMFSE-UHFFFAOYSA-N
Molecular formula
C8H8Cl2N2O
Average molar mass
219.06 g/mol

Names & identifiers

Preferred name
5,6-Dichloro-N-ethylnicotinamide
IUPAC
5,6-dichloro-N-ethylpyridine-3-carboxamide

Names & synonyms

5,6-Dichloro-N-ethylnicotinamide906559-30-65,6-DICHLORO-N-ETHYLPYRIDINE-3-CARBOXAMIDESCHEMBL2960085GAIXUJQSFWMFSE-UHFFFAOYSA-N5,6-Dichloro-N-ethyl-nicotinamideMFCD04692297AKOS0001590085,6-Dichloro-N-ethyl-3-pyridinecarboxamideDB-4133265,6-dichloro-N-ethyl-pyridine-3-carboxamideA1-27525

Database identifiers

PubChem CID
20120133

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
189

Related reactions

7 records
New reaction record
HRID 90236 reaction equation
HRID 90236As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 502540 reaction equation
HRID 502540As productuspto-grants-2010_08
HRID 1221090 reaction equation
HRID 1221090As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1430091 reaction equation
HRID 1430091As productuspto-grants-2015_01
HRID 1430092 reaction equation
HRID 1430092As reactantuspto-grants-2015_01
HRID 2089109 reaction equation
HRID 2089109As productuspto-grants-2013_05
HRID 2089110 reaction equation
HRID 2089110As reactantuspto-grants-2013_05

Compound notes

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