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

C11H9FN2OS — CID 2320472

IUPAC2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2ccccc2F)s1
InChIInChI=1S/C11H9FN2OS/c1-7-6-13-11(16-7)14-10(15)8-4-2-3-5-9(8)12/h2-6H,1H3,(H,13,14,15)
InChIKeyQRJKNILKQIBARO-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.84
Rot. Bonds2

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

2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 2320472) has the molecular formula C11H9FN2OS and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID2320472
Molecular FormulaC11H9FN2OS
Molecular Weight236.27 g/mol
Exact Mass236.04
IUPAC Name2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2ccccc2F)s1
InChIInChI=1S/C11H9FN2OS/c1-7-6-13-11(16-7)14-10(15)8-4-2-3-5-9(8)12/h2-6H,1H3,(H,13,14,15)
InChIKeyQRJKNILKQIBARO-UHFFFAOYSA-N
XLogP2.84
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 2320472) is 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1cnc(NC(=O)c2ccccc2F)s1.
What is the InChIKey of 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is QRJKNILKQIBARO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2OS/c1-7-6-13-11(16-7)14-10(15)8-4-2-3-5-9(8)12/h2-6H,1H3,(H,13,14,15).
What are the key properties of 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 236.27 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 2320472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).