Basic information
- CAS
41175-88-6- Standard SMILES
CC1Cc2c(n(C)c3ccccc23)C(c2cccnc2)N1.Cl- InChIKey
WDPCRIPQASQXCB-UHFFFAOYSA-N- Molecular formula
- C18H20ClN3
- Average molar mass
- 313.8 g/mol
- Monoisotopic mass
- 313.1345753
Names & identifiers
- Preferred name
- 1H-Pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-3,9-dimethyl-1-(3-pyridinyl)-, monohydrochloride
- IUPAC
- 3,9-dimethyl-1-pyridin-3-yl-1,2,3,4-tetrahydropyrido[3,4-b]indole;hydrochloride
Names & synonyms
2,3,4,9-Tetrahydro-3,9-dimethyl-1-(3-pyridinyl)-1H-pyrido(3,4-b)indole hydrochloride41175-88-61H-Pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-3,9-dimethyl-1-(3-pyridinyl)-, monohydrochlorideRefChem:240203DTXSID009614853,9-Dimethyl-1-(pyridin-3-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1)
Database identifiers
- CAS
41175-88-6- PubChem CID
- 218682
- DTXSID
DTXSID00961485
Properties
Computed structural properties
- Topological polar surface area
- 29.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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