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Home > Pyridines > 1422133-35-4
1422133-35-4 | N-((4aS,8R,8aS)-octahydro-2H-pyrano[3,2-c]pyridin-8-yl)nicotinamide
CAS No: 1422133-35-4 Catalog No: AG01DI19 MDL No:
Product Description
Catalog Number:
AG01DI19
Chemical Name:
N-((4aS,8R,8aS)-octahydro-2H-pyrano[3,2-c]pyridin-8-yl)nicotinamide
CAS Number:
1422133-35-4
Molecular Formula:
C14H19N3O2
Molecular Weight:
261.3196
IUPAC Name:
N-[(4aS,8R,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-pyrano[3,2-c]pyridin-8-yl]pyridine-3-carboxamide
InChI:
InChI=1S/C14H19N3O2/c18-14(11-3-1-5-15-8-11)17-12-9-16-7-10-4-2-6-19-13(10)12/h1,3,5,8,10,12-13,16H,2,4,6-7,9H2,(H,17,18)/t10-,12+,13-/m0/s1
InChI Key:
DPPILJPURHEVLN-UHTWSYAYSA-N
SMILES:
O=C(c1cccnc1)N[C@@H]1CNC[C@H]2[C@@H]1OCCC2
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
261.148g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.325g/mol
Monoisotopic Mass:
261.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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