SMILES:
O=C(NCC1CC2CC2N1)c1cccc2c1OCCO2Molecular Processing
Molecular formula
C15H18N2O3
Molecular weight
274.32
Exact mass
274.1317
XLogP
0.94
TPSA
59.59
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
73.2
Supplementary Information
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