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(3S,4R)-N,N-dibenzyl-3-methoxypiperidin-4-amine

(3S,4R)-N,N-dibenzyl-3-methoxypiperidin-4-amine

CAS: 860169-74-0

Formula: C20H26N2O

SMILES: CO[C@H]1CNCC[C@H]1N(CC1=CC=CC=C1)CC1=CC=CC=C1

IUPAC: (3S,4R)-N,N-dibenzyl-3-methoxypiperidin-4-amine

InChI: InChI=1S/C20H26N2O/c1-23-20-14-21-13-12-19(20)22(15-17-8-4-2-5-9-17)16-18-10-6-3-7-11-18/h2-11,19-21H,12-16H2,1H3/t19-,20+/m1/s1

Composition: C (77.38%), H (8.44%), N (9.02%), O (5.15%)

Molar Mass: 310.441

Atom Count: 49

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 310.204513465
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey UERXJDUECXDWNN-UXHICEINSA-N
Lipinski's Rule of Five 1
Molar Refractivity 95.22
Topological Polar Surface Area 24.5
Polarizability 37.73
Ring Count 3
Rotatable Bond Count 6

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