SMILES:
C#CC(O)c1ccc(N(C)C)c(C(C)(C)C)c1Molecular Processing
Molecular formula
C15H21NO
Molecular weight
231.34
Exact mass
231.1623
XLogP
2.72
TPSA
23.47
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
73.26
Supplementary Information
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