1,1,3,3,6-Pentamethyl-1,2,3,4-tetrahydro-gamma-carboline
Basic information
- Standard SMILES
Cc1cccc2c3c([nH]c12)CC(C)(C)NC3(C)C- InChIKey
AVMPTADIBRWHBS-UHFFFAOYSA-N- Molecular formula
- C16H22N2
- Average molar mass
- 242.36 g/mol
- Monoisotopic mass
- 242.17829871
Names & identifiers
- Preferred name
- 1,1,3,3,6-Pentamethyl-1,2,3,4-tetrahydro-gamma-carboline
- IUPAC
- 1,1,3,3,6-pentamethyl-4,5-dihydro-2H-pyrido[4,3-b]indole
Names & synonyms
1,1,3,3,6-Pentamethyl-1,2,3,4-tetrahydro-gamma-carbolineAVMPTADIBRWHBS-UHFFFAOYSA-NDTXSID3013634602,2,4,4,8-Pentamethyl-1,2,3,4-tetrahydro-.gamma.-carbolineQ633919401,1,3,3,6-Pentamethyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole #
Database identifiers
- PubChem CID
- 614871
- DTXSID
DTXSID301363460- Nikkaji
- J182.467H
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 27.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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