Basic information
- Standard SMILES
O=C(CCc1c[nH]c2ccccc12)N1CCCC1- InChIKey
GIKVDHLSSAUXLB-UHFFFAOYSA-N- Molecular formula
- C15H18N2O
- Average molar mass
- 242.32 g/mol
Names & identifiers
- Preferred name
- 3-(1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one
- IUPAC
- 3-(1H-indol-3-yl)-1-pyrrolidin-1-ylpropan-1-one
Names & synonyms
MLS001172782SCHEMBL2263678CHEMBL1735045GIKVDHLSSAUXLB-UHFFFAOYSA-NHMS2887L18AKOS008928539SMR0005924883-(1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one3-(1H-indol-3-yl)-1-pyrrolidin-1-yl-propan-1-oneZ31480113F5882-5720
Database identifiers
- PubChem CID
- 4806783
- ChEMBL
CHEMBL1735045
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 299
Experimental & physicochemical properties
Solubility>36.3 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
2 records
Compound notes
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