trivial
MDPHP
3',4'-Methylenedioxy-α-pyrrolidinohexiophenone
METHYLENEDIOXYPYRROLIDINOHEXIOPHENONE
systemic
1-(1,3-benzodioxol-5-yl)-2-pyrrolidin-1-yl-hexan-1-one
1-(2'H'-1,3-Benzodioxol-5-yl)-2-(pyrrolidin-1-yl)hexan-1-one
MDPHP
3',4'-Methylenedioxy-α-pyrrolidinohexiophenone
METHYLENEDIOXYPYRROLIDINOHEXIOPHENONE
systemic
1-(1,3-benzodioxol-5-yl)-2-pyrrolidin-1-yl-hexan-1-one
1-(2'H'-1,3-Benzodioxol-5-yl)-2-(pyrrolidin-1-yl)hexan-1-one
Identifiers
InChIKey: OBLFRFGUZZRECT-UHFFFAOYSA-N
Formula: C17H23NO3
CAS Registry numbers:
776994-64-0
Descriptors
Bioavailability-related
Molecular weight: 289.17 DaPartition coefficient: 3.25
H bond donors: 0
H bond acceptors: 4
Rotatable bonds: 6
Molar refractivity: 81.02 J mol-1 K-1
Polar surface area: 38.77 Å2
Generic
Stereocenters: 1Heteroatoms: 4
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 3Heterocycles: 2
Aromatic rings: 1
Aromatic carbocycles: 1
Aromatic heterocycles: 0
Aliphatic rings: 2
Aliphatic carbocycles: 0
Aliphatic heterocycles: 2