2,8-dibromo-5-chloro-6-methylquinoline

C10H6Br2ClN — CID 102941285

IUPAC2,8-dibromo-5-chloro-6-methylquinoline
SMILESCc1cc(Br)c2nc(Br)ccc2c1Cl
InChIInChI=1S/C10H6Br2ClN/c1-5-4-7(11)10-6(9(5)13)2-3-8(12)14-10/h2-4H,1H3
InChIKeyQUZUZNJEOPGAAU-UHFFFAOYSA-N
MW335.43 g/mol
LogP4.72
Rot. Bonds

About 2,8-dibromo-5-chloro-6-methylquinoline

2,8-dibromo-5-chloro-6-methylquinoline (PubChem CID 102941285) has the molecular formula C10H6Br2ClN and a molecular weight of 335.43 g/mol. Its IUPAC name is 2,8-dibromo-5-chloro-6-methylquinoline.

Molecular Properties

Compound Name2,8-dibromo-5-chloro-6-methylquinoline
PubChem CID102941285
Molecular FormulaC10H6Br2ClN
Molecular Weight335.43 g/mol
Exact Mass332.86
IUPAC Name2,8-dibromo-5-chloro-6-methylquinoline
SMILESCc1cc(Br)c2nc(Br)ccc2c1Cl
InChIInChI=1S/C10H6Br2ClN/c1-5-4-7(11)10-6(9(5)13)2-3-8(12)14-10/h2-4H,1H3
InChIKeyQUZUZNJEOPGAAU-UHFFFAOYSA-N
XLogP4.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.43
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-5-chloro-6,8-dimethoxyquinoline
CID 102941242
2,5-dibromo-6-fluoro-8-methylquinoline
CID 107594212
(8-bromo-5-chloro-3-ethyl-6-methylquinolin-2-yl)hydrazine
CID 104725289
5-bromo-8-chloro-7-methylisoquinoline
CID 125427065
8-bromo-6-chloro-2,4-dimethylquinoline
CID 82580896
4-bromo-7,8-dichloro-2-methylquinoline
CID 39346159
2-bromo-8-chloro-4-methylquinoline
CID 82580985
4,8-dibromo-3-chloro-2,6-dimethylquinoline
CID 121236438
6,8-dibromo-4-chloro-2-(2-methylphenyl)quinazoline
CID 63497501
8-bromo-4-chloro-3-methyl-6-propan-2-ylquinoline
CID 171373295
6,8-dibromo-4-chloro-2-(5-chloro-2-methylphenyl)quinazoline
CID 82870561
2-bromo-8-fluoro-6-methylquinoline
CID 102941093

Frequently Asked Questions

What is the IUPAC name of 2,8-dibromo-5-chloro-6-methylquinoline?
The IUPAC name of 2,8-dibromo-5-chloro-6-methylquinoline (CID 102941285) is 2,8-dibromo-5-chloro-6-methylquinoline.
What is the SMILES notation for 2,8-dibromo-5-chloro-6-methylquinoline?
The canonical SMILES for 2,8-dibromo-5-chloro-6-methylquinoline is Cc1cc(Br)c2nc(Br)ccc2c1Cl.
What is the InChIKey of 2,8-dibromo-5-chloro-6-methylquinoline?
The InChIKey is QUZUZNJEOPGAAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2ClN/c1-5-4-7(11)10-6(9(5)13)2-3-8(12)14-10/h2-4H,1H3.
What are the key properties of 2,8-dibromo-5-chloro-6-methylquinoline?
2,8-dibromo-5-chloro-6-methylquinoline has a molecular weight of 335.43 g/mol, XLogP of 4.72, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dibromo-5-chloro-6-methylquinoline is sourced from PubChem (CID 102941285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).