2-amino-3-(2H-benzotriazol-2-yl)-2-methylpropionitrile

HCID 66620380
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Basic information

Standard SMILES
CC(N)(C#N)Cn1nc2ccccc2n1
InChIKey
YUFVMQFAYAVIEE-UHFFFAOYSA-N
Molecular formula
C10H11N5
Average molar mass
201.23 g/mol

Names & identifiers

Preferred name
2-amino-3-(2H-benzotriazol-2-yl)-2-methylpropionitrile
IUPAC
2-amino-3-(benzotriazol-2-yl)-2-methylpropanenitrile

Names & synonyms

SCHEMBL203923YUFVMQFAYAVIEE-UHFFFAOYSA-N2-amino-3-(2H-benzotriazol-2-yl)-2-methylpropionitrile

Database identifiers

PubChem CID
66620380

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
80.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
15

Related reactions

5 records
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Compound notes

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