Molecule ID: 3501942

IUPAC Name: 1-[1-(4-methoxyphenyl)-2-(methylamino)ethyl]cyclohexan-1-ol

Description: The molecule is a monomethoxybenzene that is the N-desmethyl derivative of venlafaxine. It has a role as a marine xenobiotic metabolite and a drug metabolite. It is a member of cyclohexanols, a monomethoxybenzene and a secondary amino compound.

SMILES: CNCC(c1ccc(OC)cc1)C1(O)CCCCC1

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

InChI: InChI=1S/C16H25NO2/c1-17-12-15(16(18)10-4-3-5-11-16)13-6-8-14(19-2)9-7-13/h6-9,15,17-18H,3-5,10-12H2,1-2H3

Molecular Properties:
- Polar Surface Area: 41.5 Ų
- LogP: 3.0