1-(6-Bromo-2-methylpyridin-3-yl)-2-oxopyrrolidin-3-yl acetate

HCID 89905587
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Basic information

Standard SMILES
CC(=O)OC1CCN(c2ccc(Br)nc2C)C1=O
InChIKey
IPPIXLSWGBHPLK-UHFFFAOYSA-N
Molecular formula
C12H13BrN2O3
Average molar mass
313.15 g/mol
Monoisotopic mass
312.01095

Names & identifiers

Preferred name
1-(6-Bromo-2-methylpyridin-3-yl)-2-oxopyrrolidin-3-yl acetate
IUPAC
[1-(6-bromo-2-methyl-3-pyridinyl)-2-oxopyrrolidin-3-yl] acetate

Names & synonyms

SCHEMBL15390050IPPIXLSWGBHPLK-UHFFFAOYSA-N1-(6-bromo-2-methylpyridin-3-yl)-2-oxopyrrolidin-3-yl acetate

Database identifiers

PubChem CID
89905587

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
59.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18

Related reactions

2 records
New reaction record

Compound notes

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