2-Nitro-5-(4-acetylamino-1-piperidyl)benzaldehyde dimethylacetal

HCID 19086863
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Basic information

Standard SMILES
COC(OC)c1cc(N2CCC(NC(C)=O)CC2)ccc1[N+](=O)[O-]
InChIKey
RBJHZUPSJQMZMF-UHFFFAOYSA-N
Molecular formula
C16H23N3O5
Average molar mass
337.37 g/mol

Names & identifiers

Preferred name
2-Nitro-5-(4-acetylamino-1-piperidyl)benzaldehyde dimethylacetal
IUPAC
N-[1-[3-(dimethoxymethyl)-4-nitrophenyl]piperidin-4-yl]acetamide

Names & synonyms

SCHEMBL7283793RBJHZUPSJQMZMF-UHFFFAOYSA-N2-nitro-5-(4-acetylamino-1-piperidyl)benzaldehyde dimethylacetal

Database identifiers

PubChem CID
19086863

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
96.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
24

Related reactions

6 records
New reaction record

Linked notes

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