SMILES:
Cc1cccc(CC2(C(N)=O)CCNCC2)c1Molecular Processing
Molecular formula
C14H20N2O
Molecular weight
232.33
Exact mass
232.1576
XLogP
1.39
TPSA
55.12
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
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
0.5
Molar refractivity
68.61
Supplementary Information
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