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89596-05-4

89596-05-4 | Methanone, [6-methyl-2-(1-piperidinyl)-3-pyridinyl]phenyl-

CAS No: 89596-05-4 Catalog No: AG003XJO MDL No:

Product Description

Catalog Number:
AG003XJO
Chemical Name:
Methanone, [6-methyl-2-(1-piperidinyl)-3-pyridinyl]phenyl-
CAS Number:
89596-05-4
Molecular Formula:
C18H20N2O
Molecular Weight:
280.3642
IUPAC Name:
(6-methyl-2-piperidin-1-ylpyridin-3-yl)-phenylmethanone
InChI:
InChI=1S/C18H20N2O/c1-14-10-11-16(17(21)15-8-4-2-5-9-15)18(19-14)20-12-6-3-7-13-20/h2,4-5,8-11H,3,6-7,12-13H2,1H3
InChI Key:
BJUAZBNMLZXYEK-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(nc1N1CCCCC1)C)c1ccccc1

Properties

Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.158g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.371g/mol
Monoisotopic Mass:
280.158g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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