SMILES:
Cc1cccc(CNC2=NCCO2)c1CMolecular Processing
Molecular formula
C12H16N2O
Molecular weight
204.27
Exact mass
204.1263
XLogP
1.78
TPSA
33.62
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
61.01
Supplementary Information
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Involved in 2 reactions→