5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole

C15H13FN2S — CID 59669902

IUPAC5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole
SMILESCc1cc(F)c2nc(-c3sc(C)nc3C)ccc2c1
InChIInChI=1S/C15H13FN2S/c1-8-6-11-4-5-13(18-14(11)12(16)7-8)15-9(2)17-10(3)19-15/h4-7H,1-3H3
InChIKeyYBOIXXSEPOJYSV-UHFFFAOYSA-N
MW272.35 g/mol
LogP4.42
Rot. Bonds1

About 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole

5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole (PubChem CID 59669902) has the molecular formula C15H13FN2S and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole
PubChem CID59669902
Molecular FormulaC15H13FN2S
Molecular Weight272.35 g/mol
Exact Mass272.08
IUPAC Name5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole
SMILESCc1cc(F)c2nc(-c3sc(C)nc3C)ccc2c1
InChIInChI=1S/C15H13FN2S/c1-8-6-11-4-5-13(18-14(11)12(16)7-8)15-9(2)17-10(3)19-15/h4-7H,1-3H3
InChIKeyYBOIXXSEPOJYSV-UHFFFAOYSA-N
XLogP4.42
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole (CID 59669902) is 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole is Cc1cc(F)c2nc(-c3sc(C)nc3C)ccc2c1.
What is the InChIKey of 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole?
The InChIKey is YBOIXXSEPOJYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2S/c1-8-6-11-4-5-13(18-14(11)12(16)7-8)15-9(2)17-10(3)19-15/h4-7H,1-3H3.
What are the key properties of 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole?
5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole has a molecular weight of 272.35 g/mol, XLogP of 4.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-fluoro-6-methylquinolin-2-yl)-2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 59669902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).