4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline

C15H9Cl2FN2 — CID 59631137

IUPAC4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline
SMILESCc1c(-c2ccccn2)nc2c(Cl)ccc(F)c2c1Cl
InChIInChI=1S/C15H9Cl2FN2/c1-8-13(17)12-10(18)6-5-9(16)15(12)20-14(8)11-4-2-3-7-19-11/h2-7H,1H3
InChIKeyLKZFPUIQONYCRA-UHFFFAOYSA-N
MW307.16 g/mol
LogP5.05
Rot. Bonds1

About 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline

4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline (PubChem CID 59631137) has the molecular formula C15H9Cl2FN2 and a molecular weight of 307.16 g/mol. Its IUPAC name is 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline.

Molecular Properties

Compound Name4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline
PubChem CID59631137
Molecular FormulaC15H9Cl2FN2
Molecular Weight307.16 g/mol
Exact Mass306.01
IUPAC Name4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline
SMILESCc1c(-c2ccccn2)nc2c(Cl)ccc(F)c2c1Cl
InChIInChI=1S/C15H9Cl2FN2/c1-8-13(17)12-10(18)6-5-9(16)15(12)20-14(8)11-4-2-3-7-19-11/h2-7H,1H3
InChIKeyLKZFPUIQONYCRA-UHFFFAOYSA-N
XLogP5.05
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.16
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

4-chloro-5-fluoro-3,8-dimethyl-2-pyridin-2-ylquinoline
CID 59631265
4-chloro-7-fluoro-3-methyl-2,6-dipyridin-2-ylquinoline
CID 59631148
4-chloro-7-fluoro-3-methyl-2,6-dipyridin-2-ylquinoline;4,6-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline;4,6-dichloro-7-fluoro-3-methyl-2-pyridin-2-ylquinoline;2,4,6-trichloro-5-fluoro-3-methylquinoline;2,4,6-trichloro-7-fluoro-3-methylquinoline
CID 158164548
5,8-dimethyl-2,3-dipyridin-2-ylquinoxaline
CID 21026689
4,6-dichloro-7-methoxy-3-methyl-2-pyridin-2-ylquinoline
CID 59631212
2,3-dibromo-4,5-dimethyl-6-pyridin-2-ylpyridine
CID 54330183
2-(4-chloro-2-fluorophenyl)pyridine
CID 57200729
2-chloro-3-fluoro-6-pyridin-2-ylpyridine
CID 175788383
4,8-dichloro-5-fluoro-2-phenylquinoline
CID 107530938
8-chloro-5-fluoroquinoline
CID 53435993
8-chloro-3-ethyl-2-pyridin-2-ylquinoline
CID 70898648
4-chloro-8-fluoro-2,3,5-trimethylquinoline
CID 60996951

Frequently Asked Questions

What is the IUPAC name of 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline?
The IUPAC name of 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline (CID 59631137) is 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline.
What is the SMILES notation for 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline?
The canonical SMILES for 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline is Cc1c(-c2ccccn2)nc2c(Cl)ccc(F)c2c1Cl.
What is the InChIKey of 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline?
The InChIKey is LKZFPUIQONYCRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2FN2/c1-8-13(17)12-10(18)6-5-9(16)15(12)20-14(8)11-4-2-3-7-19-11/h2-7H,1H3.
What are the key properties of 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline?
4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline has a molecular weight of 307.16 g/mol, XLogP of 5.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dichloro-5-fluoro-3-methyl-2-pyridin-2-ylquinoline is sourced from PubChem (CID 59631137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).