N#CCOc1cccc2cc[nH]c12
SMILES: N#CCOc1cccc2cc[nH]c12

Molecular Processing

Molecular formula
C10H8N2O
Molecular weight
172.19
Exact mass
172.0637
XLogP
2.07
TPSA
48.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
49.41

Supplementary Information

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