N-Dimethylcarbamoylmethyl-4-methylamino-3-nitro-benzamide

HCID 9303598
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Basic information

Standard SMILES
CNc1ccc(C(=O)NCC(=O)N(C)C)cc1[N+](=O)[O-]
InChIKey
HXSCZIWAUFPZEC-UHFFFAOYSA-N
Molecular formula
C12H16N4O4
Average molar mass
280.28 g/mol

Names & identifiers

Preferred name
N-Dimethylcarbamoylmethyl-4-methylamino-3-nitro-benzamide
IUPAC
N-[2-(dimethylamino)-2-oxoethyl]-4-(methylamino)-3-nitrobenzamide

Names & synonyms

SCHEMBL2245658HXSCZIWAUFPZEC-UHFFFAOYSA-NN-Dimethylcarbamoylmethyl-4-methylamino-3-nitro-benzamide

Database identifiers

PubChem CID
9303598

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20

Related reactions

2 records
New reaction record

Compound notes

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