Molecule ID: 114911

IUPAC Name: 6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline

Description: The molecule is an isoquinoline alkaloid that is the N-methyl derivative of 5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline. It is an isoquinoline alkaloid fundamental parent, an aporphine alkaloid and a tertiary amino compound.

SMILES: CN1CCc2cccc3c2C1Cc1ccccc1-3

SELFIES: [C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2]

InChI: InChI=1S/C17H17N/c1-18-10-9-12-6-4-8-15-14-7-3-2-5-13(14)11-16(18)17(12)15/h2-8,16H,9-11H2,1H3

Molecular Properties:
- Polar Surface Area: 3.2 Ų
- LogP: 3.0