1,1-Dimethylethyl 4-{[(6-bromo-3-pyridinyl)oxy]methyl}-1-piperidinecarboxylate

HCID 57930201

Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC(COc2ccc(Br)nc2)CC1
InChIKey
SSMZXTWLXRPKNZ-UHFFFAOYSA-N
Molecular formula
C16H23BrN2O3
Average molar mass
371.27 g/mol

Names & identifiers

Preferred name
1,1-Dimethylethyl 4-{[(6-bromo-3-pyridinyl)oxy]methyl}-1-piperidinecarboxylate
IUPAC
tert-butyl 4-[(6-bromo-3-pyridinyl)oxymethyl]piperidine-1-carboxylate

Names & synonyms

SCHEMBL384358SCHEMBL29674744SSMZXTWLXRPKNZ-UHFFFAOYSA-NDB-388392A1-02285tert-butyl 4-(((6-bromopyridin-3-yl)oxy)methyl)piperidine-1-carboxylate1,1 -Dimethylethyl 4-{[(6-bromo-3-pyridinyl)oxy]methyl}-1-piperidinecarboxylate1,1-dimethylethyl 4-{[(6-bromo-3-pyridinyl)oxy]methyl}-1-piperidinecarboxylate4-(6-Bromo-pyridin-3-yloxymethyl)-piperidine-1-carboxylic acid tert-butyl ester1032825-09-4

Database identifiers

PubChem CID
57930201

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
51.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
22

Related reactions

16 records

Compound notes

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