Basic information
- Standard SMILES
COC(=O)c1cn(-c2ccccc2C(C)C)c2ccccc12- InChIKey
OPUNGWFNCSIWML-UHFFFAOYSA-N- Molecular formula
- C19H19NO2
- Average molar mass
- 293.4 g/mol
Names & identifiers
- Preferred name
- methyl 1-(2-isopropylphenyl)-1H-indole-3-carboxylate
- IUPAC
- methyl 1-(2-propan-2-ylphenyl)indole-3-carboxylate
Names & synonyms
SCHEMBL2000654OPUNGWFNCSIWML-UHFFFAOYSA-Nmethyl 1-(2-isopropylphenyl)-1H-indole-3-carboxylate
Database identifiers
- PubChem CID
- 67243100
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 395
Related reactions
4 records
Compound notes
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