SMILES:
CC1CCC(C(C)C)C(C(=O)NCC#CCO)C1Molecular Processing
Molecular formula
C15H25NO2
Molecular weight
251.37
Exact mass
251.1885
XLogP
1.81
TPSA
49.33
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
72.7
Supplementary Information
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