Molecule ID: 3180

IUPAC Name: 1-(4-butoxyphenyl)-3-piperidin-1-ylpropan-1-one

Description: The molecule is n-Ethylpiperidine in which one of the hydrogens attached to the methyl group is substituted by a 4-butoxybenzoyl group. It has a role as a topical anaesthetic. It is a member of piperidines and an aromatic ketone.

SMILES: CCCCOc1ccc(C(=O)CCN2CCCCC2)cc1

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

InChI: InChI=1S/C18H27NO2/c1-2-3-15-21-17-9-7-16(8-10-17)18(20)11-14-19-12-5-4-6-13-19/h7-10H,2-6,11-15H2,1H3

Molecular Properties:
- Polar Surface Area: 29.5 Ų
- LogP: 3.6