2,3,4,9-Tetrahydro-2-methyl-9-(phenylmethyl)-1H-pyrido[3,4-b]indol-1-one
Basic information
- CAS
59156-99-9- Standard SMILES
CN1CCc2c(n(Cc3ccccc3)c3ccccc23)C1=O- InChIKey
OEVLUORQKMJWNQ-UHFFFAOYSA-N- Molecular formula
- C19H18N2O
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.1419132
Names & identifiers
- Preferred name
- 2,3,4,9-Tetrahydro-2-methyl-9-(phenylmethyl)-1H-pyrido[3,4-b]indol-1-one
- IUPAC
- 9-benzyl-2-methyl-3,4-dihydropyrido[3,4-b]indol-1-one
Names & synonyms
2,3,4,9-Tetrahydro-2-methyl-9-(phenylmethyl)-1H-pyrido[3,4-b]indol-1-one59156-99-92,3,4,9-Tetrahydro-2-methyl-9-(phenylmethyl)-1H-pyrido(3,4-b)indol-1-oneRefChem:243981DTXSID8011506489-Benzyl-2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-one
Database identifiers
- CAS
59156-99-9- PubChem CID
- 905830
- DTXSID
DTXSID801150648
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 418
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Compound notes
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