trivial
Dibutylone
bk-MMBDB
DIBUTYLON
DIBUTYLONUM
systemic
2-Dimethylamino-1-(3,4-methylenedioxyphenyl)butan-1-one

Identifiers

InChIKey: USEBIPUIVPERGC-UHFFFAOYSA-N

Formula: C13H17NO3

CAS Registry numbers:
802286-83-5

Descriptors

Bioavailability-related

Molecular weight: 235.12 Da
Partition coefficient: 1.94
H bond donors: 0
H bond acceptors: 4
Rotatable bonds: 4
Molar refractivity: 64.66 J mol-1 K-1
Polar surface area: 38.77 Å2

Generic

Stereocenters: 1
Heteroatoms: 4
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0

Ring-related

Rings: 2
Heterocycles: 1
Aromatic rings: 1
Aromatic carbocycles: 1
Aromatic heterocycles: 0
Aliphatic rings: 1
Aliphatic carbocycles: 0
Aliphatic heterocycles: 1