N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide

C15H11FN2O2S — CID 953564

IUPACN-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1nc2ccc(F)cc2s1
InChIInChI=1S/C15H11FN2O2S/c16-10-6-7-12-13(8-10)21-15(17-12)18-14(19)9-20-11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18,19)
InChIKeyWYNKRDMYYTVJSP-UHFFFAOYSA-N
MW302.33 g/mol
LogP3.45
Rot. Bonds4

About N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide

N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide (PubChem CID 953564) has the molecular formula C15H11FN2O2S and a molecular weight of 302.33 g/mol. Its IUPAC name is N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide
PubChem CID953564
Molecular FormulaC15H11FN2O2S
Molecular Weight302.33 g/mol
Exact Mass302.05
IUPAC NameN-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1nc2ccc(F)cc2s1
InChIInChI=1S/C15H11FN2O2S/c16-10-6-7-12-13(8-10)21-15(17-12)18-14(19)9-20-11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18,19)
InChIKeyWYNKRDMYYTVJSP-UHFFFAOYSA-N
XLogP3.45
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-benzoylphenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide
CID 2550667
2-(4-fluorophenoxy)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
CID 16547554
2-(2-cyanophenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide
CID 7733369
2-(2-fluorophenoxy)-N-(6-phenoxy-1,3-benzothiazol-2-yl)acetamide
CID 7948442
N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(2-oxochromen-7-yl)oxyacetamide
CID 35999133
N-(6-bromo-1,3-benzothiazol-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 17410216
N-(1,3-benzothiazol-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 8882895
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(3-phenoxyphenoxy)acetamide
CID 2347857
2-benzylsulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide
CID 963436
N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide
CID 2430791
2-(4-ethylphenoxy)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
CID 2484391
2-(3-acetamidophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
CID 18870050

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide?
The IUPAC name of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide (CID 953564) is N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1nc2ccc(F)cc2s1.
What is the InChIKey of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide?
The InChIKey is WYNKRDMYYTVJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2S/c16-10-6-7-12-13(8-10)21-15(17-12)18-14(19)9-20-11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18,19).
What are the key properties of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide?
N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide has a molecular weight of 302.33 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-phenoxyacetamide is sourced from PubChem (CID 953564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).