Name: nipecotic acid
SMILES:
O=C(O)C1CCCNC1Molecular Processing
Molecular formula
C6H11NO2
Molecular weight
129.16
Exact mass
129.079
XLogP
0.07
TPSA
49.33
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
33.23
Supplementary Information
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