Basic information
- CAS
849515-20-4- Standard SMILES
Cc1ccc(CN(C)C(=O)CCc2c[nH]c3ccccc23)o1- InChIKey
CAAPKUGDNNVPJI-UHFFFAOYSA-N- Molecular formula
- C18H20N2O2
- Average molar mass
- 296.4 g/mol
- Monoisotopic mass
- 296.15247789
Names & identifiers
- Preferred name
- 3-(1H-indol-3-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
- IUPAC
- 3-(1H-indol-3-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
Names & synonyms
MLS0011770573-(1H-indol-3-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamideSMR000596106CHEMBL1360430BDBM90897cid_4807502DTXSID801322463HMS2902C08AKOS034173270NCGC00277518-01849515-20-4AB00840415-06
Show more names
Z318576173-(1H-indol-3-yl)-N-methyl-N-[(5-methyl-2-furanyl)methyl]propanamide3-(1H-indol-3-yl)-N-methyl-N-[(5-methyl-2-furyl)methyl]propionamide
Database identifiers
- CAS
849515-20-4- PubChem CID
- 4807502
- DTXSID
DTXSID801322463- ChEMBL
CHEMBL1360430
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 387
Experimental & physicochemical properties
Solubility6.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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