5-Bromo-N-methoxy-N-methylpyridine-2-carboxamide - CAS 1211592-38-9
Catalog: |
BB071585 |
Product Name: |
5-Bromo-N-methoxy-N-methylpyridine-2-carboxamide |
CAS: |
1211592-38-9 |
Synonyms: |
5-Bromo-N-methoxy-N-methylpicolinamide; 5-bromo-N-methoxy-N-methylpyridine-2-carboxamide; (3S,4S)-1-tert-butyl 3-ethyl 4-(cyanomethyl)pyrrolidine-1,3-dicarboxylate; 5-bromo-N-methoxy-N-methyl picolinamide |
IUPAC Name: | 5-bromo-N-methoxy-N-methylpyridine-2-carboxamide |
Description: | 5-Bromo-N-methoxy-N-methylpyridine-2-carboxamide |
Molecular Weight: | 245.07 |
Molecular Formula: | C8H9BrN2O2 |
Canonical SMILES: | CN(C(=O)C1=NC=C(C=C1)Br)OC |
InChI: | InChI=1S/C8H9BrN2O2/c1-11(13-2)8(12)7-4-3-6(9)5-10-7/h3-5H,1-2H3 |
InChI Key: | YQUKLNVJRGVRKM-UHFFFAOYSA-N |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.98474 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.98474 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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