rac-5-{[2-(5-Fluoro-2-methoxyphenyl)ethyl]amino}-5,6,7,8-tetrahydroquinoline-2-carbonitrile
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COc1ccc(F)cc1CCNC1CCCc2nc(C#N)ccc21- InChIKey
QVAOMKHMGRFWHV-UHFFFAOYSA-N- Molecular formula
- C19H20FN3O
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.15904043
Names & identifiers
- Preferred name
- rac-5-{[2-(5-Fluoro-2-methoxyphenyl)ethyl]amino}-5,6,7,8-tetrahydroquinoline-2-carbonitrile
- IUPAC
- 5-[2-(5-fluoro-2-methoxyphenyl)ethylamino]-5,6,7,8-tetrahydroquinoline-2-carbonitrile
Names & synonyms
SCHEMBL15437173QVAOMKHMGRFWHV-UHFFFAOYSA-Nrac-5-{[2-(5-Fluoro-2-methoxyphenyl)ethyl]amino}-5,6,7,8-tetrahydroquinoline-2-carbonitrile
Database identifiers
- PubChem CID
- 89940804
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 451
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…