COc1ccc(CCN2CCC[C@@H](Cl)C2)cc1
이름: (R)-3-chloro-1-(4-methoxyphenethyl)piperidine
SMILES: COc1ccc(CCN2CCC[C@@H](Cl)C2)cc1

Molecular Processing

Molecular formula
C14H20ClNO
Molecular weight
253.77
Exact mass
253.1233
XLogP
2.94
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
72.01

Supplementary Information

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