CCCCN(C)C(=O)CC(=O)C[C@H](O)CC#N
SMILES: CCCCN(C)C(=O)CC(=O)C[C@H](O)CC#N

Molecular Processing

Molecular formula
C12H20N2O3
Molecular weight
240.3
Exact mass
240.1474
XLogP
0.87
TPSA
81.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
17
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
63.02

Supplementary Information

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