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Home > Pyridines > 1422137-56-1
1422137-56-1 | (4R,4aR,8aR)-N-(pyridin-2-ylmethyl)octahydro-2H-pyrano[3,2-c]pyridine-4-carboxamide
CAS No: 1422137-56-1 Catalog No: AG01DIK6 MDL No:
Product Description
Catalog Number:
AG01DIK6
Chemical Name:
(4R,4aR,8aR)-N-(pyridin-2-ylmethyl)octahydro-2H-pyrano[3,2-c]pyridine-4-carboxamide
CAS Number:
1422137-56-1
Molecular Formula:
C15H21N3O2
Molecular Weight:
275.3461
IUPAC Name:
(4R,4aR,8aR)-N-(pyridin-2-ylmethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-pyrano[3,2-c]pyridine-4-carboxamide
InChI:
InChI=1S/C15H21N3O2/c19-15(18-9-11-3-1-2-6-17-11)12-5-8-20-14-4-7-16-10-13(12)14/h1-3,6,12-14,16H,4-5,7-10H2,(H,18,19)/t12-,13+,14-/m1/s1
InChI Key:
OADNEGGMKLLBMJ-HZSPNIEDSA-N
SMILES:
O=C([C@@H]1CCO[C@H]2[C@H]1CNCC2)NCc1ccccn1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
275.163g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.352g/mol
Monoisotopic Mass:
275.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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