6-bromo-4-chloro-8-fluoro-2-methylquinoline

C10H6BrClFN — CID 43668643

IUPAC6-bromo-4-chloro-8-fluoro-2-methylquinoline
SMILESCc1cc(Cl)c2cc(Br)cc(F)c2n1
InChIInChI=1S/C10H6BrClFN/c1-5-2-8(12)7-3-6(11)4-9(13)10(7)14-5/h2-4H,1H3
InChIKeyZUQUNBICVNSQMA-UHFFFAOYSA-N
MW274.52 g/mol
LogP4.10
Rot. Bonds

About 6-bromo-4-chloro-8-fluoro-2-methylquinoline

6-bromo-4-chloro-8-fluoro-2-methylquinoline (PubChem CID 43668643) has the molecular formula C10H6BrClFN and a molecular weight of 274.52 g/mol. Its IUPAC name is 6-bromo-4-chloro-8-fluoro-2-methylquinoline.

Molecular Properties

Compound Name6-bromo-4-chloro-8-fluoro-2-methylquinoline
PubChem CID43668643
Molecular FormulaC10H6BrClFN
Molecular Weight274.52 g/mol
Exact Mass272.94
IUPAC Name6-bromo-4-chloro-8-fluoro-2-methylquinoline
SMILESCc1cc(Cl)c2cc(Br)cc(F)c2n1
InChIInChI=1S/C10H6BrClFN/c1-5-2-8(12)7-3-6(11)4-9(13)10(7)14-5/h2-4H,1H3
InChIKeyZUQUNBICVNSQMA-UHFFFAOYSA-N
XLogP4.10
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.52
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-chloro-8-fluoro-2-methylquinoline?
The IUPAC name of 6-bromo-4-chloro-8-fluoro-2-methylquinoline (CID 43668643) is 6-bromo-4-chloro-8-fluoro-2-methylquinoline.
What is the SMILES notation for 6-bromo-4-chloro-8-fluoro-2-methylquinoline?
The canonical SMILES for 6-bromo-4-chloro-8-fluoro-2-methylquinoline is Cc1cc(Cl)c2cc(Br)cc(F)c2n1.
What is the InChIKey of 6-bromo-4-chloro-8-fluoro-2-methylquinoline?
The InChIKey is ZUQUNBICVNSQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrClFN/c1-5-2-8(12)7-3-6(11)4-9(13)10(7)14-5/h2-4H,1H3.
What are the key properties of 6-bromo-4-chloro-8-fluoro-2-methylquinoline?
6-bromo-4-chloro-8-fluoro-2-methylquinoline has a molecular weight of 274.52 g/mol, XLogP of 4.10, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-chloro-8-fluoro-2-methylquinoline is sourced from PubChem (CID 43668643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).