SMILES:
NC(=O)C1(c2ccccc2)CCNCC1Molecular Processing
Molecular formula
C12H16N2O
Molecular weight
204.27
Exact mass
204.1263
XLogP
0.79
TPSA
55.12
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
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
0.417
Molar refractivity
59.42
Supplementary Information
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