Name: 2-[(2R,5S)-5-(3,4,5-trifluorophenyl)pyrrolidine-2-yl]propan-2-ol
SMILES:
CC(C)(O)[C@H]1CC[C@@H](c2cc(F)c(F)c(F)c2)N1Molecular Processing
Molecular formula
C13H16F3NO
Molecular weight
259.27
Exact mass
259.1184
XLogP
2.67
TPSA
32.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
61.51
Supplementary Information
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