5H-Pyrido(3,4-b)indole, 8,9-dihydro-1,9-dimethyl-6-methoxy-
Basic information
- CAS
31965-08-9- Standard SMILES
COC1=CCc2c(c3ccnc(C)c3n2C)C1- InChIKey
CPANUUSZWDRNHZ-UHFFFAOYSA-N- Molecular formula
- C14H16N2O
- Average molar mass
- 228.29 g/mol
- Monoisotopic mass
- 228.12626314
Names & identifiers
- Preferred name
- 5H-Pyrido(3,4-b)indole, 8,9-dihydro-1,9-dimethyl-6-methoxy-
- IUPAC
- 6-methoxy-1,9-dimethyl-5,8-dihydropyrido[3,4-b]indole
Names & synonyms
BRN 06597165,8-Dihydro-6-methoxy-9-methylharman5H-Pyrido(3,4-b)indole, 8,9-dihydro-1,9-dimethyl-6-methoxy-31965-08-98,9-Dihydro-1,9-dimethyl-6-methoxy-5H-pyrido(3,4-b)indoleDTXSID901857945-23-12-00149 (Beilstein Handbook Reference)RefChem:305751DTXCID301082856-Methoxy-1,9-dimethyl-8,9-dihydro-5H-pyrido[3,4-b]indole
Database identifiers
- CAS
31965-08-9- PubChem CID
- 208299
- DTXSID
DTXSID90185794
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 328
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Compound notes
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