Name: 5-(tert-butyl)-2-(2,5-dimethylpyrrolyl)aniline
SMILES:
Cc1cc(-c2ccc(C(C)(C)C)cc2N)c(C)[nH]1Molecular Processing
Molecular formula
C16H22N2
Molecular weight
242.37
Exact mass
242.1783
XLogP
4.18
TPSA
41.81
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
78.82
Supplementary Information
Details werden geladen…
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