Tert-butyl 1-(5-fluoro-2-nitrophenyl)-piperidin-4-ylcarbamate

HCID 69044868
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Basic information

Standard SMILES
CC(C)(C)OC(=O)NC1CCN(c2cc(F)ccc2[N+](=O)[O-])CC1
InChIKey
LBWBATBWRBCKRO-UHFFFAOYSA-N
Molecular formula
C16H22FN3O4
Average molar mass
339.36 g/mol

Names & identifiers

Preferred name
Tert-butyl 1-(5-fluoro-2-nitrophenyl)-piperidin-4-ylcarbamate
IUPAC
tert-butyl N-[1-(5-fluoro-2-nitrophenyl)piperidin-4-yl]carbamate

Names & synonyms

SCHEMBL4439214LBWBATBWRBCKRO-UHFFFAOYSA-Ntert-butyl 1-(5-fluoro-2-nitrophenyl)-piperidin-4-ylcarbamate

Database identifiers

PubChem CID
69044868

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
87.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
24

Related reactions

1 records
New reaction record

Linked notes

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Tert-butyl 1-(5-fluoro-2-nitrophenyl)-piperidin-4-ylcarbamate (HCID 69044868)｜Huagongshe