SMILES:
CCN1C(=O)CCCc2cc(N)c(OC)cc21Molecular Processing
Molecular formula
C13H18N2O2
Molecular weight
234.3
Exact mass
234.1368
XLogP
1.97
TPSA
55.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
68.37
Supplementary Information
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