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Compound
4-Cyclopropylamino-nicotinonitrile
HCID
59596459
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
N#Cc1cnccc1NC1CC1
InChIKey
XOGZSCOZBYEWDF-UHFFFAOYSA-N
Molecular formula
C9H9N3
Average molar mass
159.19 g/mol
Names & identifiers
Preferred name
4-Cyclopropylamino-nicotinonitrile
IUPAC
4-(cyclopropylamino)pyridine-3-carbonitrile
Names & synonyms
SCHEMBL1920243
4-Cyclopropylamino-nicotinonitrile
XOGZSCOZBYEWDF-UHFFFAOYSA-N
Database identifiers
PubChem CID
59596459
Properties
Computed structural properties
XLogP
1.7
Topological polar surface area
48.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
201
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Show all 8 / 8
Related reactions
3 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
803921
As product
Test data from https://doi.org/10.1039/C8SC04228D
HRID
2264947
As product
uspto-grants-2010_12
HRID
2264948
As reactant
uspto-grants-2010_12
Compound notes
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