2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C11H8ClFN2OS — CID 2673064

IUPAC2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2c(F)cccc2Cl)s1
InChIInChI=1S/C11H8ClFN2OS/c1-6-5-14-11(17-6)15-10(16)9-7(12)3-2-4-8(9)13/h2-5H,1H3,(H,14,15,16)
InChIKeyOIIPZSCPZWMOFQ-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.50
Rot. Bonds2

About 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide

2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2673064) has the molecular formula C11H8ClFN2OS and a molecular weight of 270.72 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID2673064
Molecular FormulaC11H8ClFN2OS
Molecular Weight270.72 g/mol
Exact Mass270.00
IUPAC Name2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2c(F)cccc2Cl)s1
InChIInChI=1S/C11H8ClFN2OS/c1-6-5-14-11(17-6)15-10(16)9-7(12)3-2-4-8(9)13/h2-5H,1H3,(H,14,15,16)
InChIKeyOIIPZSCPZWMOFQ-UHFFFAOYSA-N
XLogP3.50
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 2673064) is 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1cnc(NC(=O)c2c(F)cccc2Cl)s1.
What is the InChIKey of 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is OIIPZSCPZWMOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2OS/c1-6-5-14-11(17-6)15-10(16)9-7(12)3-2-4-8(9)13/h2-5H,1H3,(H,14,15,16).
What are the key properties of 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 270.72 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2673064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).