4-Methoxy-1-methyl-2-oxo-1,2,5,6-tetrahydropyridine-3-carbonitrile - CAS 1421314-07-9
Catalog: |
BB009302 |
Product Name: |
4-Methoxy-1-methyl-2-oxo-1,2,5,6-tetrahydropyridine-3-carbonitrile |
CAS: |
1421314-07-9 |
Synonyms: |
4-methoxy-1-methyl-6-oxo-2,3-dihydropyridine-5-carbonitrile; 4-methoxy-1-methyl-6-oxo-2,3-dihydropyridine-5-carbonitrile |
IUPAC Name: | 4-methoxy-1-methyl-6-oxo-2,3-dihydropyridine-5-carbonitrile |
Description: | 4-Methoxy-1-methyl-2-oxo-1,2,5,6-tetrahydropyridine-3-carbonitrile (CAS# 1421314-07-9 ) is a useful research chemical. |
Molecular Weight: | 166.18 |
Molecular Formula: | C8H10N2O2 |
Canonical SMILES: | CN1CCC(=C(C1=O)C#N)OC |
InChI: | InChI=1S/C8H10N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H2,1-2H3 |
InChI Key: | YQISINGDCYNORP-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
TW-201639845-A | Novel heteroaryl and heterocyclic compounds, compositions and methods thereof | 20150129 |
WO-2016119707-A1 | Novel heteroaryl and heterocycle compounds, compositions and methods | 20150129 |
Complexity: | 285 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.074227566 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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