4-Hydroxy-3-cyano-6-methylindole
Basic information
- Standard SMILES
Cc1cc(O)c2c(C#N)c[nH]c2c1- InChIKey
QVSSPSJKVXLUHQ-UHFFFAOYSA-N- Molecular formula
- C10H8N2O
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.06366288
Names & identifiers
- Preferred name
- 4-Hydroxy-3-cyano-6-methylindole
- IUPAC
- 4-hydroxy-6-methyl-1H-indole-3-carbonitrile
Names & synonyms
SCHEMBL10569838QVSSPSJKVXLUHQ-UHFFFAOYSA-N4-hydroxy-3-cyano-6-methylindole4-hydroxy-3-cyano-6-methyl-indole
Database identifiers
- PubChem CID
- 21243577
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 245
Related reactions
2 records
Compound notes
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