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N-(5-Bromo-2-methoxy-pyridin-3-yl)-N-methyl-acetamide

HCID 59619892
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Basic information

Standard SMILES
COc1ncc(Br)cc1N(C)C(C)=O
InChIKey
UFKAVUDPMATTRN-UHFFFAOYSA-N
Molecular formula
C9H11BrN2O2
Average molar mass
259.1 g/mol

Names & identifiers

Preferred name
N-(5-Bromo-2-methoxy-pyridin-3-yl)-N-methyl-acetamide
IUPAC
N-(5-bromo-2-methoxy-3-pyridinyl)-N-methylacetamide

Names & synonyms

1257553-89-1SCHEMBL2067734UFKAVUDPMATTRN-UHFFFAOYSA-NDA-46600N-(5-Bromo-2-methoxy-pyridin-3-yl)-N-methyl-acetamide

Database identifiers

PubChem CID
59619892

Properties

Computed structural propertiesFilling in

XLogP
1.2
Topological polar surface area
42.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
213

Related reactions

2 records
New reaction record
HRID 166975 reaction equation
HRID 166975As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 445611 reaction equation
HRID 445611As productuspto-grants-2013_07

Compound notes

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