SMILES:
COC1=NC(C(C)C)C(OC)=NC1Molecular Processing
Molecular formula
C9H16N2O2
Molecular weight
184.24
Exact mass
184.1212
XLogP
1.11
TPSA
43.18
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
52.38
Supplementary Information
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