Basic information
- CAS
3250-94-0- Standard SMILES
COc1ccc2[nH]c3c(c2c1)CCCN3C- InChIKey
FSPWAFNUZMFVRQ-UHFFFAOYSA-N- Molecular formula
- C13H16N2O
- Average molar mass
- 216.28 g/mol
- Monoisotopic mass
- 216.12626314
Names & identifiers
- Preferred name
- 1H-Pyrido(2,3-b)indole, 2,3,4,9-tetrahydro-6-methoxy-1-methyl-
- IUPAC
- 6-methoxy-1-methyl-2,3,4,9-tetrahydropyrido[2,3-b]indole
Names & synonyms
1H-Pyrido(2,3-b)indole, 2,3,4,9-tetrahydro-6-methoxy-1-methyl-1-Methyl-6-methoxy-1,2,3,4-tetrahydrocarboline1-Metylo-6-metoksy-1,2,3,4-tetrahydrokarboliny [Polish]3250-94-02,3,4,9-Tetrahydro-6-methoxy-1-methyl-1H-pyrido(2,3-b)indoleDTXSID101862281-Metylo-6-metoksy-1,2,3,4-tetrahydrokarbolinyRefChem:240155DTXCID201087196-Methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[2,3-b]indole
Database identifiers
- CAS
3250-94-0- PubChem CID
- 201103
- DTXSID
DTXSID10186228
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 28.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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