N-Methyl-γ-oxo-3-pyridinebutanamide
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N-Methyl-γ-oxo-3-pyridinebutanamide
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CAS No:
713-05-3
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Formula:
C10H12N2O2
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Chemical Name:
N-Methyl-γ-oxo-3-pyridinebutanamide
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Synonyms:
3-Pyridinebutanamide,N-methyl-γ-oxo-;3-Pyridinebutyramide,N-methyl-γ-oxo-;N-Methyl-γ-oxo-3-pyridinebutanamide;γ-(3-Pyridyl)-γ-oxo-N-methylbutyramide;Ba 2702;N-Methyl-4-oxo-4-(pyridin-3-yl)butanamide
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CAS No:
Characteristics
59.06000
1.18140
Solid
1.133g/cm3
117-120ºC
448.2ºC at 760 mmHg
224.9ºC
1.523
0.004287 mg/L @ 25 °C (est)
-20ºC Freezer
Drug Information
4-Oxo-4-(3-pyridyl)-N-methylbutanamide is a known thirdhand smoke metabolite of Nicotine.
gamma-(3-pyridyl)-gamma-oxo-N-methylbutyramide
N-Methyl-γ-oxo-3-pyridinebutanamide Use and Manufacturing
An metabolite of Cotinine. In equilibrium with 5?Hydroxycotinine the cyclized form
Computed Properties
Molecular Weight:192.21
XLogP3:-0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:192.089877630
Monoisotopic Mass:192.089877630
Topological Polar Surface Area:59.1
Heavy Atom Count:14
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
N-Methyl-γ-oxo-3-pyridinebutanamide
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