6-Methyl-1-(2-nitrophenyl)-1,2,3,4-tetrahydroquinoline
Basic information
- Standard SMILES
Cc1ccc2c(c1)CCCN2c1ccccc1[N+](=O)[O-]- InChIKey
QEXUAPRDXLQDNP-UHFFFAOYSA-N- Molecular formula
- C16H16N2O2
- Average molar mass
- 268.31 g/mol
- Monoisotopic mass
- 268.12117776
Names & identifiers
- Preferred name
- 6-Methyl-1-(2-nitrophenyl)-1,2,3,4-tetrahydroquinoline
- IUPAC
- 6-methyl-1-(2-nitrophenyl)-3,4-dihydro-2H-quinoline
Names & synonyms
SCHEMBL10621375QEXUAPRDXLQDNP-UHFFFAOYSA-N6-methyl-1-(2-nitrophenyl)-1,2,3,4 -tetrahydroquinoline6-methyl-1-(2-nitrophenyl)-1,2,3,4-tetrahydroquinoline
Database identifiers
- PubChem CID
- 21297656
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 355
Related reactions
6 records
Compound notes
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