2,3-Dimethyl-6-t-butyl-8-fluoro-4-methoxyacetylquinoline

HCID 69918587
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Basic information

Standard SMILES
COCC(=O)c1c(C)c(C)nc2c(F)cc(C(C)(C)C)cc12
InChIKey
GBCVBMBDKUEILI-UHFFFAOYSA-N
Molecular formula
C18H22FNO2
Average molar mass
303.4 g/mol

Names & identifiers

Preferred name
2,3-Dimethyl-6-t-butyl-8-fluoro-4-methoxyacetylquinoline
IUPAC
1-(6-tert-butyl-8-fluoro-2,3-dimethylquinolin-4-yl)-2-methoxyethanone

Names & synonyms

SCHEMBL6855568GBCVBMBDKUEILI-UHFFFAOYSA-N2,3-dimethyl-6-t-butyl-8-fluoro-4-methoxyacetylquinoline

Database identifiers

PubChem CID
69918587

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22

Related reactions

2 records
New reaction record

Compound notes

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