Basic information
- Standard SMILES
CN(C)CCC=C1c2cc(N)ccc2C=Cn2cccc21- InChIKey
DDVNVKNPJUMLOO-UHFFFAOYSA-N- Molecular formula
- C18H21N3
- Average molar mass
- 279.4 g/mol
Names & identifiers
- Preferred name
- 9-amino-11-(3-dimethylaminopropylidene)-11H-pyrrolo[2,1-b][3]benzazepine
- IUPAC
- 11-[3-(dimethylamino)propylidene]pyrrolo[2,1-b][3]benzazepin-9-amine
Names & synonyms
SCHEMBL11645010DDVNVKNPJUMLOO-UHFFFAOYSA-N9-amino-11-(3-dimethylaminopropylidene)-11H-pyrrolo[2,1-b][3]benzazepine
Database identifiers
- PubChem CID
- 53755083
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 34.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 413
Related reactions
4 records
Compound notes
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