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Home > Pyridines > 1422139-37-4
1422139-37-4 | (3aR,7R,7aR)-N-(2-methylpyridin-3-yl)octahydropyrano[3,4-c]pyrrole-7-carboxamide
CAS No: 1422139-37-4 Catalog No: AG01DI1E MDL No:
Product Description
Catalog Number:
AG01DI1E
Chemical Name:
(3aR,7R,7aR)-N-(2-methylpyridin-3-yl)octahydropyrano[3,4-c]pyrrole-7-carboxamide
CAS Number:
1422139-37-4
Molecular Formula:
C14H19N3O2
Molecular Weight:
261.3196
IUPAC Name:
(3aR,7R,7aR)-N-(2-methylpyridin-3-yl)-1,2,3,3a,4,6,7,7a-octahydropyrano[3,4-c]pyrrole-7-carboxamide
InChI:
InChI=1S/C14H19N3O2/c1-9-13(3-2-4-16-9)17-14(18)12-8-19-7-10-5-15-6-11(10)12/h2-4,10-12,15H,5-8H2,1H3,(H,17,18)/t10-,11-,12+/m1/s1
InChI Key:
PXGGARVTJQIGSN-UTUOFQBUSA-N
SMILES:
O=C([C@H]1COC[C@@H]2[C@H]1CNC2)Nc1cccnc1C
Properties
Complexity:
337
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:
-0.1
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