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524-40-3 molecular structure
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4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile

ChemBase ID: 177533
Molecular Formular: C8H8N2O2
Molecular Mass: 164.16132
Monoisotopic Mass: 164.05857751
SMILES and InChIs

SMILES:
c1cc(c(c(=O)n1C)C#N)OC
Canonical SMILES:
N#Cc1c(OC)ccn(c1=O)C
InChI:
InChI=1S/C8H8N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H,1-2H3
InChIKey:
PETSAYFQSGAEQY-UHFFFAOYSA-N

Cite this record

CBID:177533 http://www.chembase.cn/molecule-177533.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
IUPAC Traditional name
ricinine
4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
Synonyms
1,2-Dihydro-4-methoxy-1-methyl-2-oxo-3-pyridinecarbonitrile
1,2-Dihydro-4-methoxy-1-methyl-2-oxonicotinonitrile
Recinine
NSC 409913
NSC 642604
Ricinin
Ricinine
1,2-Dihydro-4-methoxy-1-methyl-2-oxo-3-pyridinecarbonitrile; 4-Methoxy-2-oxo-1-methyl-1,2-dihydronicotinonitrile
3-Cyano-4-methoxy-1-methyl-2-pyridone
Ricinine
CAS Number
524-40-3
PubChem SID
164233443
PubChem CID
10666

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 10666 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.2337896  LogD (pH = 7.4) -0.2337896 
Log P -0.2337896  Molar Refractivity 44.6391 cm3
Polarizability 16.039297 Å3 Polar Surface Area 53.33 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Pharmacology Properties Product Information Bioassay(PubChem)
MSDS Link
Download expand Show data source
Mechanism of Action
Blocker of the GABA(A) receptor expand Show data source
Certificate of Analysis
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Biological Source
Alkaloid from Ricinus communis (castor-oil) seed (Euphorbiaceae) expand Show data source
Application(s)
Nootropic expand Show data source

DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - R495550 external link
Ricinine is an alkaloid extract from the seeds of the castor-oil plant (Ricinus communalis). Ricinine is a central nervous system stimulant that could potentially be a cognition-enhancing agent used for the treatment of human amnesias. Ricinine also has b

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • Feraz, A.C. et al.: Pharmacol. Biochem. Behav., 63, 367 (1999)
  • • Zhao, Z. et al.: Zhong. Niang., 6, 13 (1999)
  • • Tuson, R.V., J.C.S., 1864, 17, 195, (isol)
  • • Spth, E. et al., Ber., 1925, 58, 2124, (synth, bibl)
  • • Robinson, W.E. et al., J. Biol. Chem., 1964, 239, 4257, (ir, uv, synth)
  • • Walker, G.R. et al., Anal. Biochem., 1966, 16, 277, (ms)
  • • Sugasawa, T., Chem. Pharm. Bull., 1974, 22, 763, (synth, ir, pmr)
  • • Robinson, T., Phytochemistry, 1978, 17, 1903, (biosynth)
  • • Soriano-Garcia, M., Acta Cryst. C, 1989, 45, 957, (cryst struct)
  • • Sax, N.I., Dangerous Properties of Industrial Materials, 5th edn., Van Nostrand Reinhold, 1979
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PATENTS

PATENTS

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INTERNET

INTERNET

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