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88584-89-8 | Piperidine, 1-(oxo-3-pyridinylacetyl)-
CAS No: 88584-89-8 Catalog No: AG004BNT MDL No:
Product Description
Catalog Number:
AG004BNT
Chemical Name:
Piperidine, 1-(oxo-3-pyridinylacetyl)-
CAS Number:
88584-89-8
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
IUPAC Name:
1-piperidin-1-yl-2-pyridin-3-ylethane-1,2-dione
InChI:
InChI=1S/C12H14N2O2/c15-11(10-5-4-6-13-9-10)12(16)14-7-2-1-3-8-14/h4-6,9H,1-3,7-8H2
InChI Key:
KFNRSXJXCMLCAV-UHFFFAOYSA-N
SMILES:
O=C(C(=O)N1CCCCC1)c1cccnc1
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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