COc1cc2c(cc1OC)CCN=C2
SMILES: COc1cc2c(cc1OC)CCN=C2

Molecular Processing

Molecular formula
C11H13NO2
Molecular weight
191.23
Exact mass
191.0946
XLogP
1.68
TPSA
30.82
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
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
0.364
Molar refractivity
55.71

Supplementary Information

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