5-Bromo-6-(tetrahydro-furan-2-ylmethoxy)-pyridine-2-carboxylic acid ((S)-1-carbamoyl-3-methyl-butyl)-amide

HCID 71105643
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Basic information

Standard SMILES
CC(C)C[C@H](NC(=O)c1ccc(Br)c(OCC2CCCO2)n1)C(N)=O
InChIKey
SYCYMBWSJFYULZ-IAXJKZSUSA-N
Molecular formula
C17H24BrN3O4
Average molar mass
414.3 g/mol
Monoisotopic mass
413.09502

Names & identifiers

Preferred name
5-Bromo-6-(tetrahydro-furan-2-ylmethoxy)-pyridine-2-carboxylic acid ((S)-1-carbamoyl-3-methyl-butyl)-amide
IUPAC
N-[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]-5-bromo-6-(oxolan-2-ylmethoxy)pyridine-2-carboxamide

Names & synonyms

SCHEMBL14226285SYCYMBWSJFYULZ-IAXJKZSUSA-N5-Bromo-6-(tetrahydro-furan-2-ylmethoxy)-pyridine-2-carboxylic acid ((S)-1-carbamoyl-3-methyl-butyl)-amide

Database identifiers

PubChem CID
71105643

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
104 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
25

Related reactions

4 records
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Compound notes

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