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Home > Pyridines > 1422068-09-4
1422068-09-4 | (3S,4aS,8aR)-N-(furan-2-ylmethyl)octahydro-2H-pyrano[3,2-c]pyridine-3-carboxamide
CAS No: 1422068-09-4 Catalog No: AG01DI4Y MDL No:
Product Description
Catalog Number:
AG01DI4Y
Chemical Name:
(3S,4aS,8aR)-N-(furan-2-ylmethyl)octahydro-2H-pyrano[3,2-c]pyridine-3-carboxamide
CAS Number:
1422068-09-4
Molecular Formula:
C14H20N2O3
Molecular Weight:
264.3202
IUPAC Name:
(3S,4aS,8aR)-N-(furan-2-ylmethyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-pyrano[3,2-c]pyridine-3-carboxamide
InChI:
InChI=1S/C14H20N2O3/c17-14(16-8-12-2-1-5-18-12)11-6-10-7-15-4-3-13(10)19-9-11/h1-2,5,10-11,13,15H,3-4,6-9H2,(H,16,17)/t10-,11-,13+/m0/s1
InChI Key:
UZEJGRRKBFYBEK-GMXVVIOVSA-N
SMILES:
O=C([C@@H]1CO[C@H]2[C@@H](C1)CNCC2)NCc1ccco1
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
264.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.325g/mol
Monoisotopic Mass:
264.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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