Tert-butyl 1-(4-acetyl-2-nitrophenyl)piperidin-4-ylcarbamate

HCID 51119762
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Basic information

Standard SMILES
CC(=O)c1ccc(N2CCC(NC(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1
InChIKey
UBTMFKYCMUYQGB-UHFFFAOYSA-N
Molecular formula
C18H25N3O5
Average molar mass
363.4 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL4439259UBTMFKYCMUYQGB-UHFFFAOYSA-NAKOS034504227DB-199074Z646253420tert-butyl 1-(4-acetyl-2-nitrophenyl)piperidin-4-ylcarbamateN-[1-(4-acetyl-2-nitrophenyl)-4-piperidinyl]carbamic acid 1,1-dimethylethyl ester1052705-21-1

Database identifiers

PubChem CID
51119762

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
104 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
26

Related reactions

1 records
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Compound notes

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