Name: 2-benzylamino-cyclopentanecarboxylic acid ethyl ester
SMILES:
CCOC(=O)C1CCCC1NCc1ccccc1Molecular Processing
Molecular formula
C15H21NO2
Molecular weight
247.34
Exact mass
247.1572
XLogP
2.51
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
71.04
Supplementary Information
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