3,4-dibromo-6-fluoro-8-methylquinoline

C10H6Br2FN — CID 114763946

IUPAC3,4-dibromo-6-fluoro-8-methylquinoline
SMILESCc1cc(F)cc2c(Br)c(Br)cnc12
InChIInChI=1S/C10H6Br2FN/c1-5-2-6(13)3-7-9(12)8(11)4-14-10(5)7/h2-4H,1H3
InChIKeyPQDNEJUHJAXVSP-UHFFFAOYSA-N
MW318.97 g/mol
LogP4.21
Rot. Bonds

About 3,4-dibromo-6-fluoro-8-methylquinoline

3,4-dibromo-6-fluoro-8-methylquinoline (PubChem CID 114763946) has the molecular formula C10H6Br2FN and a molecular weight of 318.97 g/mol. Its IUPAC name is 3,4-dibromo-6-fluoro-8-methylquinoline.

Molecular Properties

Compound Name3,4-dibromo-6-fluoro-8-methylquinoline
PubChem CID114763946
Molecular FormulaC10H6Br2FN
Molecular Weight318.97 g/mol
Exact Mass316.89
IUPAC Name3,4-dibromo-6-fluoro-8-methylquinoline
SMILESCc1cc(F)cc2c(Br)c(Br)cnc12
InChIInChI=1S/C10H6Br2FN/c1-5-2-6(13)3-7-9(12)8(11)4-14-10(5)7/h2-4H,1H3
InChIKeyPQDNEJUHJAXVSP-UHFFFAOYSA-N
XLogP4.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.97
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-6-fluoro-8-methylquinoline-3-carboxylic acid
CID 97033444
3,8-dibromo-4-chloro-6-fluoroquinoline
CID 114759885
3,8-difluoro-5-methyl-1,10-phenanthroline
CID 59318960
ethyl 4-amino-6-fluoro-8-methylquinoline-3-carboxylate
CID 54773005
6-fluoro-4-methyl-1,3-benzothiazole
CID 53413085
4,6-dibromo-3,5-dichloro-8-methylquinoline
CID 164661316
6-fluoro-4-(2-hydroxyethylamino)-8-methylquinoline-3-carbonitrile
CID 133381697
6-fluoro-2,8-dimethylquinolin-4-amine
CID 54772876
2-bromo-5-fluoro-3-methylphenol
CID 118995128
2-bromo-1-chloro-5-fluoro-3-methylbenzene
CID 50998614
2-bromo-4-fluoro-6-methylbenzenethiol
CID 50998036
2-bromo-4-fluoro-6-methylaniline
CID 2773378

Frequently Asked Questions

What is the IUPAC name of 3,4-dibromo-6-fluoro-8-methylquinoline?
The IUPAC name of 3,4-dibromo-6-fluoro-8-methylquinoline (CID 114763946) is 3,4-dibromo-6-fluoro-8-methylquinoline.
What is the SMILES notation for 3,4-dibromo-6-fluoro-8-methylquinoline?
The canonical SMILES for 3,4-dibromo-6-fluoro-8-methylquinoline is Cc1cc(F)cc2c(Br)c(Br)cnc12.
What is the InChIKey of 3,4-dibromo-6-fluoro-8-methylquinoline?
The InChIKey is PQDNEJUHJAXVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2FN/c1-5-2-6(13)3-7-9(12)8(11)4-14-10(5)7/h2-4H,1H3.
What are the key properties of 3,4-dibromo-6-fluoro-8-methylquinoline?
3,4-dibromo-6-fluoro-8-methylquinoline has a molecular weight of 318.97 g/mol, XLogP of 4.21, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dibromo-6-fluoro-8-methylquinoline is sourced from PubChem (CID 114763946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).