8-Methoxy-4-(4,4,4-trifluoro-butylamino)-quinoline-3-carboxylic acid ethyl ester

HCID 67248643
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1cnc2c(OC)cccc2c1NCCCC(F)(F)F
InChIKey
VPCHIWIONGIIIS-UHFFFAOYSA-N
Molecular formula
C17H19F3N2O3
Average molar mass
356.34 g/mol

Names & identifiers

Preferred name
8-Methoxy-4-(4,4,4-trifluoro-butylamino)-quinoline-3-carboxylic acid ethyl ester
IUPAC
ethyl 8-methoxy-4-(4,4,4-trifluorobutylamino)quinoline-3-carboxylate

Names & synonyms

8-methoxy-4-(4,4,4-trifluoro-butylamino)-quinoline-3-carboxylic acid ethyl esterSCHEMBL2015732

Database identifiers

PubChem CID
67248643

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
60.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
25

Related reactions

6 records
New reaction record

Compound notes

Loading…