SMILES:
CCc1ccc(CC2(O)CCNCC2)cc1Molecular Processing
Molecular formula
C14H21NO
Molecular weight
219.33
Exact mass
219.1623
XLogP
1.91
TPSA
32.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
66.58
Supplementary Information
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