Basic information
- Standard SMILES
CCOC(=O)c1ccc(C(=O)OCC)n1N=CN(C)C- InChIKey
UCWFECAKJXRFKQ-UHFFFAOYSA-N- Molecular formula
- C13H19N3O4
- Average molar mass
- 281.31 g/mol
Names & identifiers
- Preferred name
- 1-(dimethylamino-methyleneamino)-1H-pyrrole-2,5-dicarboxylic acid diethyl ester
- IUPAC
- diethyl 1-(dimethylaminomethylideneamino)pyrrole-2,5-dicarboxylate
Names & synonyms
SCHEMBL5136368UCWFECAKJXRFKQ-UHFFFAOYSA-N1-(dimethylamino-methyleneamino)-1H-pyrrole-2,5-dicarboxylic acid diethyl ester
Database identifiers
- PubChem CID
- 69326532
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 345
Related reactions
3 records
Compound notes
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