Basic information
- Standard SMILES
CCCCNCN1C(=O)C(=Cc2ccc[nH]2)c2ccccc21- InChIKey
XGKGXRWQSMXYIB-UHFFFAOYSA-N- Molecular formula
- C18H21N3O
- Average molar mass
- 295.4 g/mol
Names & identifiers
- Preferred name
- 1-Butylaminomethyl-3-(1H-pyrrol-2-ylmethylene)-1,3-dihydro-indol-2-one
- IUPAC
- 1-(butylaminomethyl)-3-(1H-pyrrol-2-ylmethylidene)indol-2-one
Names & synonyms
SCHEMBL3908681XGKGXRWQSMXYIB-UHFFFAOYSA-N1-Butylaminomethyl-3-(1H-pyrrol-2-ylmethylene)-1,3-dihydro-indol-2-one
Database identifiers
- PubChem CID
- 68834641
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 421
Related reactions
4 records
Compound notes
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