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4-Cyclopropylamino-nicotinonitrile

HCID 59596459
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

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

SCHEMBL19202434-Cyclopropylamino-nicotinonitrileXOGZSCOZBYEWDF-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

Related reactions

3 records
New reaction record
HRID 803921 reaction equation
HRID 803921As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 2264947 reaction equation
HRID 2264947As productuspto-grants-2010_12
HRID 2264948 reaction equation
HRID 2264948As reactantuspto-grants-2010_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes