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Home > Pyridines > 1422061-71-9
1422061-71-9 | (3aR,7aR)-N-(furan-2-ylmethyl)octahydrofuro[3,2-c]pyridine-3a-carboxamide
CAS No: 1422061-71-9 Catalog No: AG01DHNG MDL No:
Product Description
Catalog Number:
AG01DHNG
Chemical Name:
(3aR,7aR)-N-(furan-2-ylmethyl)octahydrofuro[3,2-c]pyridine-3a-carboxamide
CAS Number:
1422061-71-9
Molecular Formula:
C13H18N2O3
Molecular Weight:
250.2936
IUPAC Name:
(3aR,7aR)-N-(furan-2-ylmethyl)-3,4,5,6,7,7a-hexahydro-2H-furo[3,2-c]pyridine-3a-carboxamide
InChI:
InChI=1S/C13H18N2O3/c16-12(15-8-10-2-1-6-17-10)13-4-7-18-11(13)3-5-14-9-13/h1-2,6,11,14H,3-5,7-9H2,(H,15,16)/t11-,13-/m1/s1
InChI Key:
IVZGIFHIZIHCLO-DGCLKSJQSA-N
SMILES:
O=C([C@@]12CNCC[C@H]2OCC1)NCc1ccco1
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
250.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.298g/mol
Monoisotopic Mass:
250.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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