الاسم: 1-(8-Amino-5,5-dimethyl-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl)-ethanone
SMILES:
CC(=O)N1CCCC(C)(C)c2ccc(N)cc21Molecular Processing
Molecular formula
C14H20N2O
Molecular weight
232.33
Exact mass
232.1576
XLogP
2.69
TPSA
46.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
17
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
0.5
Molar refractivity
71.14
Supplementary Information
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