(2,4-Dinitrophenyl)(4-methylpiperazin-1-yl)methanone

HCID 4090619

Basic information

Standard SMILES
CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1
InChIKey
NUGPANNXKFKGAI-UHFFFAOYSA-N
Molecular formula
C12H14N4O5
Average molar mass
294.26 g/mol
Monoisotopic mass
294.09641956

Names & identifiers

Preferred name
(2,4-Dinitrophenyl)(4-methylpiperazin-1-yl)methanone
IUPAC
(2,4-dinitrophenyl)-(4-methylpiperazin-1-yl)methanone

Names & synonyms

(2,4-dinitrophenyl)(4-methylpiperazin-1-yl)methanoneSCHEMBL10519748NUGPANNXKFKGAI-UHFFFAOYSA-NSTK181925AKOS0038522901-{2,4-dinitrobenzoyl}-4-methylpiperazineN1 -methyl-N4 -(2,4-dinitrobenzoyl)piperazineAG-670/09239013N1 -methyl-N4 -(2,4-dinitrobenzoyl)- piperazine

Database identifiers

PubChem CID
4090619

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
115 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
21

Related reactions

4 records

Compound notes

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