Basic information
- CAS
135017-03-7- Standard SMILES
CN/C(=C\[N+](=O)[O-])NCCNCc1ccc(CN(C)C)o1- InChIKey
FKPVAVFXTJJABH-JLHYYAGUSA-N- Molecular formula
- C13H23N5O3
- Average molar mass
- 297.35 g/mol
- Monoisotopic mass
- 297.18008961
Names & identifiers
- Preferred name
- 2,5-Furandimethanamine, N,N-dimethyl-N'-(2-((1-(methylamino)-2-nitroethenyl)amino)ethyl)-
- IUPAC
- (E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylamino]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine
Names & synonyms
2,5-Furandimethanamine, N,N-dimethyl-N'-(2-((1-(methylamino)-2-nitroethenyl)amino)ethyl)-135017-03-7RefChem:1060132N,N-Dimethyl-N'-(2-((1-(methylamino)-2-nitroethenyl)amino)ethyl)-2,5-furandimethanamineN-(2-((5-Dimethylaminomethyl-2-furanyl)methylamino)ethyl)-N'-methyl-2-nitroethene-1,1-diamineSCHEMBL9216204
Database identifiers
- CAS
135017-03-7- PubChem CID
- 3077643
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 98.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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