5-Amino-2-(2,2,2-trifluoroethoxy)nicotinonitrile

HCID 60922243
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Basic information

Standard SMILES
N#Cc1cc(N)cnc1OCC(F)(F)F
InChIKey
QEWQJILTRKMFIH-UHFFFAOYSA-N
Molecular formula
C8H6F3N3O
Average molar mass
217.15 g/mol
Monoisotopic mass
217.04629631

Names & identifiers

Preferred name
5-Amino-2-(2,2,2-trifluoroethoxy)nicotinonitrile
IUPAC
5-amino-2-(2,2,2-trifluoroethoxy)pyridine-3-carbonitrile

Names & synonyms

5-amino-2-(2,2,2-trifluoroethoxy)nicotinonitrileSCHEMBL3062400

Database identifiers

PubChem CID
60922243

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
71.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
15

Related reactions

2 records
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Compound notes

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