이름: 1-cyclohexenylmethyl-2-aminomethylpyrrolidine
SMILES:
NCC1CCCN1CC1=CCCCC1Molecular Processing
Molecular formula
C12H22N2
Molecular weight
194.32
Exact mass
194.1783
XLogP
1.91
TPSA
29.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
60.2
Supplementary Information
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