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Home > Other Heterocycles > 1422056-88-9
1422056-88-9 | (3S)-N-(furan-2-ylmethyl)-2-azabicyclo[2.2.1]heptane-3-carboxamide
CAS No: 1422056-88-9 Catalog No: AG01DK6V MDL No:
Product Description
Catalog Number:
AG01DK6V
Chemical Name:
(3S)-N-(furan-2-ylmethyl)-2-azabicyclo[2.2.1]heptane-3-carboxamide
CAS Number:
1422056-88-9
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
IUPAC Name:
(3S)-N-(furan-2-ylmethyl)-2-azabicyclo[2.2.1]heptane-3-carboxamide
InChI:
InChI=1S/C12H16N2O2/c15-12(13-7-10-2-1-5-16-10)11-8-3-4-9(6-8)14-11/h1-2,5,8-9,11,14H,3-4,6-7H2,(H,13,15)/t8?,9?,11-/m0/s1
InChI Key:
BGQKRVWGJITHFC-AMUVOQDHSA-N
SMILES:
O=C([C@H]1NC2CC1CC2)NCc1ccco1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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