SMILES:
CC1CCCC1CNc1ccc(C#N)cc1Molecular Processing
Molecular formula
C14H18N2
Molecular weight
214.31
Exact mass
214.147
XLogP
3.41
TPSA
35.82
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
66.15
Supplementary Information
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