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Home > Pyridines > 1422139-03-4
1422139-03-4 | (3aR,7aR)-N-(pyridin-2-ylmethyl)octahydrofuro[3,2-c]pyridine-3a-carboxamide
CAS No: 1422139-03-4 Catalog No: AG01DI1B MDL No:
Product Description
Catalog Number:
AG01DI1B
Chemical Name:
(3aR,7aR)-N-(pyridin-2-ylmethyl)octahydrofuro[3,2-c]pyridine-3a-carboxamide
CAS Number:
1422139-03-4
Molecular Formula:
C14H19N3O2
Molecular Weight:
261.3196
IUPAC Name:
(3aR,7aR)-N-(pyridin-2-ylmethyl)-3,4,5,6,7,7a-hexahydro-2H-furo[3,2-c]pyridine-3a-carboxamide
InChI:
InChI=1S/C14H19N3O2/c18-13(17-9-11-3-1-2-6-16-11)14-5-8-19-12(14)4-7-15-10-14/h1-3,6,12,15H,4-5,7-10H2,(H,17,18)/t12-,14-/m1/s1
InChI Key:
ABIBRWJHSRZQSN-TZMCWYRMSA-N
SMILES:
O=C([C@@]12CNCC[C@H]2OCC1)NCc1ccccn1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
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:
3
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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