CC1(C)CCCN(CCCOc2ccc(I)cc2)C1
Name: 1-{3-[(4-iodophenyl)oxy]propyl}-3,3-dimethylpiperidine
SMILES: CC1(C)CCCN(CCCOc2ccc(I)cc2)C1

Molecular Processing

Molecular formula
C16H24INO
Molecular weight
373.28
Exact mass
373.0903
XLogP
4.18
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
88.73

Supplementary Information

Details werden geladen…

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