SMILES:
CNCCCC1CCC2=C1CC=CC2Molecular Processing
Molecular formula
C13H21N
Molecular weight
191.32
Exact mass
191.1674
XLogP
3.04
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
14
Rings
2
Aromatic rings
0
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
61.28
Supplementary Information
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