이름: Ethyl 2-cyano-3-(3-ethyl-2-pyridylamino)acrylate
SMILES:
CCOC(=O)C(C#N)=CNc1ncccc1CCMolecular Processing
Molecular formula
C13H15N3O2
Molecular weight
245.28
Exact mass
245.1164
XLogP
2.03
TPSA
75.01
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
67.57
Supplementary Information
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