Name: 1-benzyl-trans-3-t-butoxycarbonylamino-4-methylpyrrolidine
SMILES:
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C17H26N2O2
Molecular weight
290.41
Exact mass
290.1994
XLogP
3.03
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
84.04
Supplementary Information
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