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Home > Other Heterocycles > 1422057-12-2
1422057-12-2 | (3S)-2-azabicyclo[2.2.1]heptan-3-yl(pyrrolidin-1-yl)methanone
CAS No: 1422057-12-2 Catalog No: AG01DIKY MDL No:
Product Description
Catalog Number:
AG01DIKY
Chemical Name:
(3S)-2-azabicyclo[2.2.1]heptan-3-yl(pyrrolidin-1-yl)methanone
CAS Number:
1422057-12-2
Molecular Formula:
C11H18N2O
Molecular Weight:
194.2734
IUPAC Name:
[(3S)-2-azabicyclo[2.2.1]heptan-3-yl]-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C11H18N2O/c14-11(13-5-1-2-6-13)10-8-3-4-9(7-8)12-10/h8-10,12H,1-7H2/t8?,9?,10-/m0/s1
InChI Key:
DTDQWUMRJKDZDP-RTBKNWGFSA-N
SMILES:
O=C([C@H]1NC2CC1CC2)N1CCCC1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
194.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.278g/mol
Monoisotopic Mass:
194.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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