8-Methoxy-2-cyanomethyl-1,2,3,3a,8,8a-hexahydroindeno[1,2-c]pyrrole

HCID 19795666
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Basic information

Standard SMILES
COC1c2ccccc2C2CN(CC#N)CC21
InChIKey
YDEOHSBZOCJOEP-UHFFFAOYSA-N
Molecular formula
C14H16N2O
Average molar mass
228.29 g/mol

Names & identifiers

Preferred name
8-Methoxy-2-cyanomethyl-1,2,3,3a,8,8a-hexahydroindeno[1,2-c]pyrrole
IUPAC
2-(4-methoxy-3,3a,4,8b-tetrahydro-1H-indeno[1,2-c]pyrrol-2-yl)acetonitrile

Names & synonyms

SCHEMBL9458026YDEOHSBZOCJOEP-UHFFFAOYSA-N8-Methoxy-2-cyanomethyl-1,2,3,3a,8,8a-hexahydroindeno[1,2-c]pyrrole

Database identifiers

PubChem CID
19795666

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
36.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17

Related reactions

3 records
New reaction record

Compound notes

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8-Methoxy-2-cyanomethyl-1,2,3,3a,8,8a-hexahydroindeno[1,2-c]pyrrole (HCID 19795666)｜Huagongshe