SMILES:
CN1C(=O)CCC(C)(C)c2cc(N)ccc21Molecular Processing
Molecular formula
C13H18N2O
Molecular weight
218.3
Exact mass
218.1419
XLogP
2.3
TPSA
46.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
66.52
Supplementary Information
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