Name: 2-[phenethyl]-5-[(3,4-methylenedioxy)-α-hydroxybenzyl]pyrrolidine
SMILES:
OC(c1ccc2c(c1)OCO2)C1CCC(CCc2ccccc2)N1Molecular Processing
Molecular formula
C20H23NO3
Molecular weight
325.41
Exact mass
325.1678
XLogP
3.2
TPSA
50.72
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
92.23
Supplementary Information
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