Basic information
- Standard SMILES
COC(=O)c1ccc(OC)c2c1ccn2C(C)C- InChIKey
KBQSZSHGSKZXBW-UHFFFAOYSA-N- Molecular formula
- C14H17NO3
- Average molar mass
- 247.29 g/mol
Names & identifiers
- Preferred name
- Methyl 1-(1-methylethyl)-7-(methyloxy)-1H-indole-4-carboxylate
- IUPAC
- methyl 7-methoxy-1-propan-2-ylindole-4-carboxylate
Names & synonyms
SCHEMBL2594926KBQSZSHGSKZXBW-UHFFFAOYSA-N1346575-84-5DB-416787methyl 1-isopropyl-7-methoxy-1H-indole-4-carboxylateMethyl 1-(1-methylethyl)-7-(methyloxy)-1H-indole-4-carboxylate
Database identifiers
- PubChem CID
- 67468655
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 305
Related reactions
14 records
Compound notes
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