Basic information
- CAS
116480-61-6- Standard SMILES
CN1CC=C(c2c[nH]c3ccc(O)cc23)CC1- InChIKey
ARDASZJGLLMNAQ-UHFFFAOYSA-N- Molecular formula
- C14H16N2O
- Average molar mass
- 228.29 g/mol
- Monoisotopic mass
- 228.12626313
Names & identifiers
- Preferred name
- 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-ol
- IUPAC
- 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-ol
Names & synonyms
116480-61-63-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-olCHEMBL268363-(1-METHYL-1,2,3,6-TETRAHYDROPYRIDIN-4-YL)-1H-INDOL-5-OLSCHEMBL5367487DTXSID60566319ARDASZJGLLMNAQ-UHFFFAOYSA-NBDBM502316653-(1-methyl-1,2,3,6-tetrahydropyridin-4-yl)-5-hydroxy-1h indole3-(1-Methyl-1,2,3,6-tetrahydropyridin-4-yl)-5-hydroxy-1H-indole
Database identifiers
- CAS
116480-61-6- PubChem CID
- 14973207
- DTXSID
DTXSID60566319- ChEMBL
CHEMBL26836- Nikkaji
- J570.969E
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 39.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 315
Related reactions
5 records
Compound notes
Loading…