4,6-dichloro-8-methoxy-3-methylquinoline

C11H9Cl2NO — CID 171373411

IUPAC4,6-dichloro-8-methoxy-3-methylquinoline
SMILESCOc1cc(Cl)cc2c(Cl)c(C)cnc12
InChIInChI=1S/C11H9Cl2NO/c1-6-5-14-11-8(10(6)13)3-7(12)4-9(11)15-2/h3-5H,1-2H3
InChIKeyQLQUEWRPJXJXOL-UHFFFAOYSA-N
MW242.10 g/mol
LogP3.86
Rot. Bonds1

About 4,6-dichloro-8-methoxy-3-methylquinoline

4,6-dichloro-8-methoxy-3-methylquinoline (PubChem CID 171373411) has the molecular formula C11H9Cl2NO and a molecular weight of 242.10 g/mol. Its IUPAC name is 4,6-dichloro-8-methoxy-3-methylquinoline.

Molecular Properties

Compound Name4,6-dichloro-8-methoxy-3-methylquinoline
PubChem CID171373411
Molecular FormulaC11H9Cl2NO
Molecular Weight242.10 g/mol
Exact Mass241.01
IUPAC Name4,6-dichloro-8-methoxy-3-methylquinoline
SMILESCOc1cc(Cl)cc2c(Cl)c(C)cnc12
InChIInChI=1S/C11H9Cl2NO/c1-6-5-14-11-8(10(6)13)3-7(12)4-9(11)15-2/h3-5H,1-2H3
InChIKeyQLQUEWRPJXJXOL-UHFFFAOYSA-N
XLogP3.86
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.10
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-7,8-difluoro-6-methoxy-3-methylquinoline
CID 171373414
4-chloro-6-methoxy-3,8-dimethylquinoline
CID 171373217
4,8-dichloro-7-methoxy-3-methylquinoline
CID 171373308
6-chloro-4-methoxy-3,8-dimethylquinoline
CID 129268371
6-bromo-4-chloro-3-methyl-8-(trifluoromethoxy)quinoline
CID 171373322
3,4-dibromo-6-chloro-8-methoxy-2-methylquinoline
CID 121237017
4,6,7-trichloro-8-fluoro-3-methylquinoline
CID 171373330
7-bromo-4-chloro-3,6,8-trimethylquinoline
CID 171373456
4-chloro-6-methoxy-3-methyl-7-(trifluoromethyl)quinoline
CID 171373255
methyl 4,6-dichloro-8-methylquinoline-3-carboxylate
CID 102614436
4-chloro-3,6,7-trimethylquinoline
CID 131861534
4-chloro-6,8-difluoro-3,7-dimethylquinoline
CID 171373268

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-8-methoxy-3-methylquinoline?
The IUPAC name of 4,6-dichloro-8-methoxy-3-methylquinoline (CID 171373411) is 4,6-dichloro-8-methoxy-3-methylquinoline.
What is the SMILES notation for 4,6-dichloro-8-methoxy-3-methylquinoline?
The canonical SMILES for 4,6-dichloro-8-methoxy-3-methylquinoline is COc1cc(Cl)cc2c(Cl)c(C)cnc12.
What is the InChIKey of 4,6-dichloro-8-methoxy-3-methylquinoline?
The InChIKey is QLQUEWRPJXJXOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2NO/c1-6-5-14-11-8(10(6)13)3-7(12)4-9(11)15-2/h3-5H,1-2H3.
What are the key properties of 4,6-dichloro-8-methoxy-3-methylquinoline?
4,6-dichloro-8-methoxy-3-methylquinoline has a molecular weight of 242.10 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-8-methoxy-3-methylquinoline is sourced from PubChem (CID 171373411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).