Basic information
- Standard SMILES
Cc1ccc(N2CCCc3ccccc32)c([N+](=O)[O-])c1- InChIKey
NFCYVZTYTJWDAF-UHFFFAOYSA-N- Molecular formula
- C16H16N2O2
- Average molar mass
- 268.31 g/mol
Names & identifiers
- Preferred name
- 1-(4-Methyl-2-nitrophenyl)-1,2,3,4-tetrahydroquinoline
- IUPAC
- 1-(4-methyl-2-nitrophenyl)-3,4-dihydro-2H-quinoline
Names & synonyms
SCHEMBL10621507NFCYVZTYTJWDAF-UHFFFAOYSA-N1-(4-methyl-2-nitrophenyl)-1,2,3,4-tetrahydroquinoline
Database identifiers
- PubChem CID
- 21297653
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
5 records
Compound notes
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