SMILES:
CCC(CC)NC(=O)c1ccc(OC)c(C)c1Molecular Processing
Molecular formula
C14H21NO2
Molecular weight
235.33
Exact mass
235.1572
XLogP
2.92
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
69.57
Supplementary Information
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