2-[(1-Methylpiperidin-3-yl)oxy]benzonitrile

HCID 68583720
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Basic information

Standard SMILES
CN1CCCC(Oc2ccccc2C#N)C1
InChIKey
JBJAECMJXRENPG-UHFFFAOYSA-N
Molecular formula
C13H16N2O
Average molar mass
216.28 g/mol
Monoisotopic mass
216.12626314

Names & identifiers

Preferred name
2-[(1-Methylpiperidin-3-yl)oxy]benzonitrile
IUPAC
2-(1-methylpiperidin-3-yl)oxybenzonitrile

Names & synonyms

SCHEMBL3291578JBJAECMJXRENPG-UHFFFAOYSA-N2-[(1-methylpiperidin-3-yl)oxy]benzonitrile

Database identifiers

PubChem CID
68583720

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
36.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Related reactions

4 records
New reaction record

Linked notes

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