SMILES:
CCC1CCN(CC#N)CC1Molecular Processing
Molecular formula
C9H16N2
Molecular weight
152.24
Exact mass
152.1313
XLogP
1.63
TPSA
27.03
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.889
Molar refractivity
45.07
Supplementary Information
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