2H-Pyrido(3,4-b)indole, 1,2-dimethyl-
Basic information
- CAS
109847-05-4- Standard SMILES
Cc1c2nc3ccccc3c-2ccn1C- InChIKey
WURQJRLLMSPUST-UHFFFAOYSA-N- Molecular formula
- C13H12N2
- Average molar mass
- 196.25 g/mol
- Monoisotopic mass
- 196.10004839
Overview
1,2-Dimethyl-2H-pyrido[3,4-b]indole has been reported in Strychnos melinoniana and Strychnos mellodora with data available.
Names & identifiers
- Preferred name
- 2H-Pyrido(3,4-b)indole, 1,2-dimethyl-
- IUPAC
- 1,2-dimethylpyrido[3,4-b]indole
- English name
- melinonine F
- Molecular weight
- 0
Names & synonyms
Melinonine F109847-05-46801-22-52H-Pyrido(3,4-b)indole, 1,2-dimethyl-Melinonine-F1,2-dimethylpyrido[3,4-b]indole1,2-dimethyl-2H-pyrido[3,4-b]indoleCHEMBL46056DTXSID70911376WURQJRLLMSPUST-UHFFFAOYSA-N.beta.-Carboline, 1,2-dimethyl-1,2-Dimethyl-2H-beta-carboline #
Show more names
2-Methylharman2[N]-Methylharmanium1,2-Dimethyl-9H-pyrido[3,4-b]indol-2-ium
9H-Pyrido(3,4-b)indolium, 1,2-dimethyl-
Database identifiers
- CAS
109847-05-4、6801-22-5- PubChem CID
- 184129
- DTXSID
DTXSID70911376- ChEMBL
CHEMBL46056
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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