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Home > Other Heterocycles > 280-13-7
280-13-7 | 8-Oxa-3-azabicyclo[3.2.1]octane
CAS No: 280-13-7 Catalog No: AG003NIX MDL No:MFCD09836264
Product Description
Catalog Number:
AG003NIX
Chemical Name:
8-Oxa-3-azabicyclo[3.2.1]octane
CAS Number:
280-13-7
Molecular Formula:
C6H11NO
Molecular Weight:
113.1576
MDL Number:
MFCD09836264
IUPAC Name:
8-oxa-3-azabicyclo[3.2.1]octane
InChI:
InChI=1S/C6H11NO/c1-2-6-4-7-3-5(1)8-6/h5-7H,1-4H2
InChI Key:
POOPWPIOIMBTOH-UHFFFAOYSA-N
SMILES:
N1CC2CCC(C1)O2
Properties
Complexity:
84.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
113.16g/mol
Monoisotopic Mass:
113.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Discovery of 2-arylthieno[3,2-d]pyrimidines containing 8-oxa-3-azabi-cyclo[3.2.1]octane in the 4-position as potent inhibitors of mTOR with selectivity over PI3K. | Bioorganic & medicinal chemistry letters 20100101 |
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