Basic information
- CAS
39744-95-1- Standard SMILES
CN(C)CCn1c2c(c3cnccc31)CCCC2.Cl.Cl- InChIKey
QZRAKJLUJWWAFB-UHFFFAOYSA-N- Molecular formula
- C15H23Cl2N3
- Average molar mass
- 316.3 g/mol
- Monoisotopic mass
- 315.1269031
Names & identifiers
- Preferred name
- 5H-Pyrido(4,3-b)indole, 5,6,7,8-tetrahydro-5-(2-(dimethylamino)ethyl)-, dihydrochloride
- IUPAC
- N,N-dimethyl-2-(6,7,8,9-tetrahydropyrido[4,3-b]indol-5-yl)ethanamine;dihydrochloride
Names & synonyms
9-(beta-Dimethylaminoethyl)-5,6,7,8-tetrahydro-gamma-carboline dihydrochloride39744-95-15-(2-(Dimethylamino)ethyl)-5,6,7,8-tetrahydro-5H-pyrido(4,3-b)indole dihydrochloride5H-Pyrido(4,3-b)indole, 5,6,7,8-tetrahydro-5-(2-(dimethylamino)ethyl)-, dihydrochlorideRefChem:305768DTXSID30960340N,N-Dimethyl-2-(6,7,8,9-tetrahydro-5H-pyrido[4,3-b]indol-5-yl)ethan-1-amine--hydrogen chloride (1/2)
Database identifiers
- CAS
39744-95-1- PubChem CID
- 217862
- DTXSID
DTXSID30960340
Properties
Computed structural properties
- Topological polar surface area
- 21.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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