2-(5-Methoxy-4-methyl-1H-indol-3-yl)acetonitrile

HCID 22018496
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Basic information

Standard SMILES
COc1ccc2[nH]cc(CC#N)c2c1C
InChIKey
CSTVPQSLVPIECP-UHFFFAOYSA-N
Molecular formula
C12H12N2O
Average molar mass
200.24 g/mol

Names & identifiers

Preferred name
2-(5-Methoxy-4-methyl-1H-indol-3-yl)acetonitrile
IUPAC
2-(5-methoxy-4-methyl-1H-indol-3-yl)acetonitrile

Names & synonyms

745060-04-22-(5-Methoxy-4-methyl-1H-indol-3-yl)acetonitrileSCHEMBL5680499CSTVPQSLVPIECP-UHFFFAOYSA-N(5-methoxy-4-methyl-1H-indol-3-yl)-acetonitrile

Database identifiers

PubChem CID
22018496

Properties

Computed structural properties

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

Related reactions

2 records
New reaction record

Linked notes

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