4-chloro-8-fluoro-2,3-dimethylquinoline

C11H9ClFN — CID 60994965

IUPAC4-chloro-8-fluoro-2,3-dimethylquinoline
SMILESCc1nc2c(F)cccc2c(Cl)c1C
InChIInChI=1S/C11H9ClFN/c1-6-7(2)14-11-8(10(6)12)4-3-5-9(11)13/h3-5H,1-2H3
InChIKeyRAISIDMLUYCCFJ-UHFFFAOYSA-N
MW209.65 g/mol
LogP3.64
Rot. Bonds

About 4-chloro-8-fluoro-2,3-dimethylquinoline

4-chloro-8-fluoro-2,3-dimethylquinoline (PubChem CID 60994965) has the molecular formula C11H9ClFN and a molecular weight of 209.65 g/mol. Its IUPAC name is 4-chloro-8-fluoro-2,3-dimethylquinoline.

Molecular Properties

Compound Name4-chloro-8-fluoro-2,3-dimethylquinoline
PubChem CID60994965
Molecular FormulaC11H9ClFN
Molecular Weight209.65 g/mol
Exact Mass209.04
IUPAC Name4-chloro-8-fluoro-2,3-dimethylquinoline
SMILESCc1nc2c(F)cccc2c(Cl)c1C
InChIInChI=1S/C11H9ClFN/c1-6-7(2)14-11-8(10(6)12)4-3-5-9(11)13/h3-5H,1-2H3
InChIKeyRAISIDMLUYCCFJ-UHFFFAOYSA-N
XLogP3.64
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.65
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-8-iodo-2,3-dimethylquinoline
CID 60996384
4-chloro-8-fluoro-2,3,5-trimethylquinoline
CID 60996951
(8-fluoro-2,3-dimethylquinolin-4-yl) acetate
CID 57303796
(8-fluoro-4-methylquinazolin-2-yl)methanamine
CID 84771826
2-bromo-4-chloro-8-fluoroquinazoline
CID 84806834
2,3-dichloro-4-fluoro-8-methylquinoline
CID 175326105
8-fluoro-2-methyl-4-propan-2-ylquinazoline
CID 139473937
4,6,8-trichloro-2,3-dimethylquinoline
CID 63409062
8-fluoro-4-methylquinoline-2-carbaldehyde
CID 82573796
(4-chloro-8-fluorocinnolin-3-yl)methanamine
CID 83885596
(4-chloro-8-fluoroquinazolin-2-yl)methanamine
CID 84781950
4-chloro-7,8-difluoro-3-iodo-2-methylquinoline
CID 121236852

Frequently Asked Questions

What is the IUPAC name of 4-chloro-8-fluoro-2,3-dimethylquinoline?
The IUPAC name of 4-chloro-8-fluoro-2,3-dimethylquinoline (CID 60994965) is 4-chloro-8-fluoro-2,3-dimethylquinoline.
What is the SMILES notation for 4-chloro-8-fluoro-2,3-dimethylquinoline?
The canonical SMILES for 4-chloro-8-fluoro-2,3-dimethylquinoline is Cc1nc2c(F)cccc2c(Cl)c1C.
What is the InChIKey of 4-chloro-8-fluoro-2,3-dimethylquinoline?
The InChIKey is RAISIDMLUYCCFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClFN/c1-6-7(2)14-11-8(10(6)12)4-3-5-9(11)13/h3-5H,1-2H3.
What are the key properties of 4-chloro-8-fluoro-2,3-dimethylquinoline?
4-chloro-8-fluoro-2,3-dimethylquinoline has a molecular weight of 209.65 g/mol, XLogP of 3.64, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-8-fluoro-2,3-dimethylquinoline is sourced from PubChem (CID 60994965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).