الاسم: 2-cyclopropyl-6-ethynyl-4,4-dimethyl-1,2,3,4-tetrahydro-isoquinoline
SMILES:
C#Cc1ccc2c(c1)C(C)(C)CN(C1CC1)C2Molecular Processing
Molecular formula
C16H19N
Molecular weight
225.33
Exact mass
225.1517
XLogP
2.92
TPSA
3.24
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
70.84
Supplementary Information
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