6-bromo-2-chloro-5-fluoro-3-methylquinoline

C10H6BrClFN — CID 177015936

IUPAC6-bromo-2-chloro-5-fluoro-3-methylquinoline
SMILESCc1cc2c(F)c(Br)ccc2nc1Cl
InChIInChI=1S/C10H6BrClFN/c1-5-4-6-8(14-10(5)12)3-2-7(11)9(6)13/h2-4H,1H3
InChIKeyCQHXUVGSYICGHO-UHFFFAOYSA-N
MW274.52 g/mol
LogP4.10
Rot. Bonds

About 6-bromo-2-chloro-5-fluoro-3-methylquinoline

6-bromo-2-chloro-5-fluoro-3-methylquinoline (PubChem CID 177015936) has the molecular formula C10H6BrClFN and a molecular weight of 274.52 g/mol. Its IUPAC name is 6-bromo-2-chloro-5-fluoro-3-methylquinoline.

Molecular Properties

Compound Name6-bromo-2-chloro-5-fluoro-3-methylquinoline
PubChem CID177015936
Molecular FormulaC10H6BrClFN
Molecular Weight274.52 g/mol
Exact Mass272.94
IUPAC Name6-bromo-2-chloro-5-fluoro-3-methylquinoline
SMILESCc1cc2c(F)c(Br)ccc2nc1Cl
InChIInChI=1S/C10H6BrClFN/c1-5-4-6-8(14-10(5)12)3-2-7(11)9(6)13/h2-4H,1H3
InChIKeyCQHXUVGSYICGHO-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-bromo-2-chloro-5-fluoro-3-methylquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-5-fluoro-2,3-dimethylquinoline;ethane
CID 177017016
2-bromo-6-chloro-3-fluoro-5-methylpyridine
CID 130114370
2-chloro-3-(cyclohexylmethyl)-4-fluoro-6-methylquinoline
CID 138637038
2-chloro-3,5,6,7-tetramethylquinoline
CID 146013311
8-bromo-2-chloro-6-fluoro-3-methylquinoline
CID 63231876
6-bromo-5-fluoro-N-methylquinazolin-2-amine
CID 165349587
1-bromo-4-chloro-2-fluoro-3-methylbenzene
CID 13340108
3-(6-bromo-5-fluoro-2-methylquinolin-3-yl)piperidine-2,6-dione;ethane
CID 177015948
6-bromo-2-chloro-4-methylquinoline;ethane
CID 153393887
6-bromo-5-fluoro-2-methylquinoxaline
CID 154727930
6-bromo-4-chloro-7-fluoro-2-(2-fluoro-3-methylphenyl)quinazoline
CID 114591270
3,5,6-trifluoro-2-methylquinoline
CID 22158739

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-chloro-5-fluoro-3-methylquinoline?
The IUPAC name of 6-bromo-2-chloro-5-fluoro-3-methylquinoline (CID 177015936) is 6-bromo-2-chloro-5-fluoro-3-methylquinoline.
What is the SMILES notation for 6-bromo-2-chloro-5-fluoro-3-methylquinoline?
The canonical SMILES for 6-bromo-2-chloro-5-fluoro-3-methylquinoline is Cc1cc2c(F)c(Br)ccc2nc1Cl.
What is the InChIKey of 6-bromo-2-chloro-5-fluoro-3-methylquinoline?
The InChIKey is CQHXUVGSYICGHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrClFN/c1-5-4-6-8(14-10(5)12)3-2-7(11)9(6)13/h2-4H,1H3.
What are the key properties of 6-bromo-2-chloro-5-fluoro-3-methylquinoline?
6-bromo-2-chloro-5-fluoro-3-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-2-chloro-5-fluoro-3-methylquinoline is sourced from PubChem (CID 177015936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).