2-ethyl-6-fluoro-3,4,7-trimethylquinoline

C14H16FN — CID 165443842

IUPAC2-ethyl-6-fluoro-3,4,7-trimethylquinoline
SMILESCCc1nc2cc(C)c(F)cc2c(C)c1C
InChIInChI=1S/C14H16FN/c1-5-13-10(4)9(3)11-7-12(15)8(2)6-14(11)16-13/h6-7H,5H2,1-4H3
InChIKeyQQYAHGSMBGGORJ-UHFFFAOYSA-N
MW217.29 g/mol
LogP3.86
Rot. Bonds1

About 2-ethyl-6-fluoro-3,4,7-trimethylquinoline

2-ethyl-6-fluoro-3,4,7-trimethylquinoline (PubChem CID 165443842) has the molecular formula C14H16FN and a molecular weight of 217.29 g/mol. Its IUPAC name is 2-ethyl-6-fluoro-3,4,7-trimethylquinoline.

Molecular Properties

Compound Name2-ethyl-6-fluoro-3,4,7-trimethylquinoline
PubChem CID165443842
Molecular FormulaC14H16FN
Molecular Weight217.29 g/mol
Exact Mass217.13
IUPAC Name2-ethyl-6-fluoro-3,4,7-trimethylquinoline
SMILESCCc1nc2cc(C)c(F)cc2c(C)c1C
InChIInChI=1S/C14H16FN/c1-5-13-10(4)9(3)11-7-12(15)8(2)6-14(11)16-13/h6-7H,5H2,1-4H3
InChIKeyQQYAHGSMBGGORJ-UHFFFAOYSA-N
XLogP3.86
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-bromo-2-ethyl-6-fluoro-3,4-dimethylquinoline
CID 165443851
(2-ethyl-7-fluoro-3,6-dimethylquinolin-4-yl)hydrazine
CID 103996238
2-ethyl-3-fluoro-5-methylquinolin-6-amine
CID 166948331
6-chloro-2-ethyl-7-fluoro-N,3-dimethylquinolin-4-amine
CID 113363430
2,4-dichloro-6-fluoro-7-methylquinazoline
CID 167510683
(2-ethyl-6,7-difluoro-3-methylquinolin-4-yl) cyclopropanecarboxylate
CID 22222485
4-chloro-3-ethyl-7-fluoro-2,6-dimethylquinoline
CID 103996076
4,5,7-trichloro-2-ethyl-6-fluoro-3-methylquinoline
CID 107577499
(2-bromo-7-fluoro-4,6-dimethylquinolin-3-yl)methanol
CID 178041010
2-ethyl-8-fluoro-3,6-dimethylquinolin-4-amine
CID 63562436
1-ethyl-6-fluoro-2,5-dimethylbenzimidazole
CID 162381509
2,4,6-triethyl-5-methylpyrimidine
CID 14199148

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-fluoro-3,4,7-trimethylquinoline?
The IUPAC name of 2-ethyl-6-fluoro-3,4,7-trimethylquinoline (CID 165443842) is 2-ethyl-6-fluoro-3,4,7-trimethylquinoline.
What is the SMILES notation for 2-ethyl-6-fluoro-3,4,7-trimethylquinoline?
The canonical SMILES for 2-ethyl-6-fluoro-3,4,7-trimethylquinoline is CCc1nc2cc(C)c(F)cc2c(C)c1C.
What is the InChIKey of 2-ethyl-6-fluoro-3,4,7-trimethylquinoline?
The InChIKey is QQYAHGSMBGGORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN/c1-5-13-10(4)9(3)11-7-12(15)8(2)6-14(11)16-13/h6-7H,5H2,1-4H3.
What are the key properties of 2-ethyl-6-fluoro-3,4,7-trimethylquinoline?
2-ethyl-6-fluoro-3,4,7-trimethylquinoline has a molecular weight of 217.29 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-fluoro-3,4,7-trimethylquinoline is sourced from PubChem (CID 165443842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).