Name: 1-(2,6-dimethyl-phenoxymethyl)-cyclopropylamine
SMILES:
Cc1cccc(C)c1OCC1(N)CC1Molecular Processing
Molecular formula
C12H17NO
Molecular weight
191.27
Exact mass
191.131
XLogP
2.17
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
57.56
Supplementary Information
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