6-bromo-3,4-diethyl-2-methylquinoline

C14H16BrN — CID 125452623

IUPAC6-bromo-3,4-diethyl-2-methylquinoline
SMILESCCc1c(C)nc2ccc(Br)cc2c1CC
InChIInChI=1S/C14H16BrN/c1-4-11-9(3)16-14-7-6-10(15)8-13(14)12(11)5-2/h6-8H,4-5H2,1-3H3
InChIKeyNSUFKOQLLMFBBE-UHFFFAOYSA-N
MW278.19 g/mol
LogP4.43
Rot. Bonds2

About 6-bromo-3,4-diethyl-2-methylquinoline

6-bromo-3,4-diethyl-2-methylquinoline (PubChem CID 125452623) has the molecular formula C14H16BrN and a molecular weight of 278.19 g/mol. Its IUPAC name is 6-bromo-3,4-diethyl-2-methylquinoline.

Molecular Properties

Compound Name6-bromo-3,4-diethyl-2-methylquinoline
PubChem CID125452623
Molecular FormulaC14H16BrN
Molecular Weight278.19 g/mol
Exact Mass277.05
IUPAC Name6-bromo-3,4-diethyl-2-methylquinoline
SMILESCCc1c(C)nc2ccc(Br)cc2c1CC
InChIInChI=1S/C14H16BrN/c1-4-11-9(3)16-14-7-6-10(15)8-13(14)12(11)5-2/h6-8H,4-5H2,1-3H3
InChIKeyNSUFKOQLLMFBBE-UHFFFAOYSA-N
XLogP4.43
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.19
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-bromo-3,4-diethyl-2-methylquinoline
CID 125453419
6-bromo-3-ethyl-2-methylquinoline-4-thiolate
CID 7362102
6-bromo-3-ethyl-2-methylquinoline-4-carboxylic acid
CID 21061136
(4-ethyl-6-fluoro-2-methylquinolin-3-yl)methanol
CID 125453119
4-ethyl-2-methyl-3-propyl-6-(trifluoromethyl)quinoline
CID 125452574
3-ethyl-2,6-dimethylquinoline-4-thiolate
CID 7362104
3-(6-bromo-2-methyl-3-propylquinolin-4-yl)sulfanylpropanoic acid
CID 1349287
6-bromo-N,N-diethyl-2-methylquinolin-4-amine
CID 110434316
6-bromo-2,3-dimethylquinoline-4-carboxylic acid
CID 43829324
6-bromo-4-chloro-2-methyl-3-(thian-4-ylmethyl)quinoline
CID 138637067
6-bromo-3-ethyl-2-(trifluoromethyl)quinoline-4-carboxylic acid
CID 160910807
(6-bromo-4-methylquinolin-2-yl)methanamine
CID 83527571

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3,4-diethyl-2-methylquinoline?
The IUPAC name of 6-bromo-3,4-diethyl-2-methylquinoline (CID 125452623) is 6-bromo-3,4-diethyl-2-methylquinoline.
What is the SMILES notation for 6-bromo-3,4-diethyl-2-methylquinoline?
The canonical SMILES for 6-bromo-3,4-diethyl-2-methylquinoline is CCc1c(C)nc2ccc(Br)cc2c1CC.
What is the InChIKey of 6-bromo-3,4-diethyl-2-methylquinoline?
The InChIKey is NSUFKOQLLMFBBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN/c1-4-11-9(3)16-14-7-6-10(15)8-13(14)12(11)5-2/h6-8H,4-5H2,1-3H3.
What are the key properties of 6-bromo-3,4-diethyl-2-methylquinoline?
6-bromo-3,4-diethyl-2-methylquinoline has a molecular weight of 278.19 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3,4-diethyl-2-methylquinoline is sourced from PubChem (CID 125452623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).