SMILES:
C#CCNNC(=O)c1cc(C)cc(C)c1Molecular Processing
Molecular formula
C12H14N2O
Molecular weight
202.26
Exact mass
202.1106
XLogP
1.17
TPSA
41.13
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
60.22
Supplementary Information
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