Basic information
- Standard SMILES
Cc1ccc2c(c1C)c1c(n2CC(C)(O)c2cccnc2)CCN(C)C1- InChIKey
VCSWBZKQTJZSAO-UHFFFAOYSA-N- Molecular formula
- C22H27N3O
- Average molar mass
- 349.5 g/mol
Names & identifiers
- Preferred name
- 2-(pyridin-3-yl)-1-(2,8,9-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2H)-yl)propan-2-ol
- IUPAC
- 2-pyridin-3-yl-1-(2,8,9-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)propan-2-ol
Names & synonyms
SCHEMBL12479368VCSWBZKQTJZSAO-UHFFFAOYSA-N2-(pyridin-3-yl)-1-(2,8,9-trimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2H)-yl)propan-2-ol
Database identifiers
- PubChem CID
- 68283229
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 500
Related reactions
3 records
Compound notes
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