Name: 1-[4-(4-amino-piperidin-1-yl)-phenyl]-ethanone
SMILES:
CC(=O)c1ccc(N2CCC(N)CC2)cc1Molecular Processing
Molecular formula
C13H18N2O
Molecular weight
218.3
Exact mass
218.1419
XLogP
1.82
TPSA
46.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
65.87
Supplementary Information
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