Tert-butyl 3-((2-bromo-5-nitropyridin-4-ylamino)methyl)piperidine-1-carboxylate

HCID 59613413
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCCC(CNc2cc(Br)ncc2[N+](=O)[O-])C1
InChIKey
WZBBJLWNIZRCEX-UHFFFAOYSA-N
Molecular formula
C16H23BrN4O4
Average molar mass
415.28 g/mol

Names & identifiers

Preferred name
Tert-butyl 3-((2-bromo-5-nitropyridin-4-ylamino)methyl)piperidine-1-carboxylate
IUPAC
tert-butyl 3-[[(2-bromo-5-nitro-4-pyridinyl)amino]methyl]piperidine-1-carboxylate

Names & synonyms

SCHEMBL619827WZBBJLWNIZRCEX-UHFFFAOYSA-Ntert-butyl 3-((2-bromo-5-nitropyridin-4-ylamino)methyl)piperidine-1-carboxylate

Database identifiers

PubChem CID
59613413

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
100 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
25

Related reactions

5 records
New reaction record

Compound notes

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