Name: methyl cis(±)-5-(4-amino-3-methoxypiperidin-1-yl)-2-methylpyridine-3-carboxylate
SMILES:
COC(=O)c1cc(N2CC[C@H](N)[C@H](OC)C2)cnc1CMolecular Processing
Molecular formula
C14H21N3O3
Molecular weight
279.34
Exact mass
279.1583
XLogP
0.73
TPSA
77.68
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
75.92
Supplementary Information
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