5-bromo-N-(2-methylbenzyl)nicotinamide

HCID 9104610
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Basic information

Standard SMILES
Cc1ccccc1CNC(=O)c1cncc(Br)c1
InChIKey
XAVLTDUUCOCZNT-UHFFFAOYSA-N
Molecular formula
C14H13BrN2O
Average molar mass
305.17 g/mol

Names & identifiers

Preferred name
5-bromo-N-(2-methylbenzyl)nicotinamide
IUPAC
5-bromo-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide

Names & synonyms

SCHEMBL1134467XAVLTDUUCOCZNT-UHFFFAOYSA-NAKOS0089559565-bromo-N-(2-methylbenzyl)nicotinamide

Database identifiers

PubChem CID
9104610

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18

Related reactions

9 records
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Compound notes

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