6-Bromo-1'-methylspiro[chroman-2,4'-piperidin]-4-one

HCID 57720805
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Basic information

Standard SMILES
CN1CCC2(CC1)CC(=O)c1cc(Br)ccc1O2
InChIKey
NNIGSNCRGHICED-UHFFFAOYSA-N
Molecular formula
C14H16BrNO2
Average molar mass
310.19 g/mol
Monoisotopic mass
309.03644

Names & identifiers

Preferred name
6-Bromo-1'-methylspiro[chroman-2,4'-piperidin]-4-one
IUPAC
6-bromo-1'-methylspiro[3H-chromene-2,4'-piperidine]-4-one

Names & synonyms

SCHEMBL1175762NNIGSNCRGHICED-UHFFFAOYSA-N6-bromo-1'-methylspiro[chroman-2,4'-piperidin]-4-one1'-methyl-6-bromo-spiro[chromane-2,4'-piperidine]-4-one

Database identifiers

PubChem CID
57720805

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
18

Related reactions

5 records
New reaction record

Compound notes

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