ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen

C8H15FN2OS — CID 154685835

IUPACethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen
SMILESCC.CC(=O)Nc1nc(F)c(C)s1.[H][H]
InChIInChI=1S/C6H7FN2OS.C2H6.H2/c1-3-5(7)9-6(11-3)8-4(2)10;1-2;/h1-2H3,(H,8,9,10);1-2H3;1H
InChIKeyWFHHIFKPYFRXLM-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.82
Rot. Bonds1

About ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen

ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen (PubChem CID 154685835) has the molecular formula C8H15FN2OS and a molecular weight of 206.29 g/mol. Its IUPAC name is ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen.

Molecular Properties

Compound Nameethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen
PubChem CID154685835
Molecular FormulaC8H15FN2OS
Molecular Weight206.29 g/mol
Exact Mass206.09
IUPAC Nameethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen
SMILESCC.CC(=O)Nc1nc(F)c(C)s1.[H][H]
InChIInChI=1S/C6H7FN2OS.C2H6.H2/c1-3-5(7)9-6(11-3)8-4(2)10;1-2;/h1-2H3,(H,8,9,10);1-2H3;1H
InChIKeyWFHHIFKPYFRXLM-UHFFFAOYSA-N
XLogP2.82
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
The IUPAC name of ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen (CID 154685835) is ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen.
What is the SMILES notation for ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
The canonical SMILES for ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen is CC.CC(=O)Nc1nc(F)c(C)s1.[H][H].
What is the InChIKey of ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
The InChIKey is WFHHIFKPYFRXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2OS.C2H6.H2/c1-3-5(7)9-6(11-3)8-4(2)10;1-2;/h1-2H3,(H,8,9,10);1-2H3;1H.
What are the key properties of ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen?
ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen has a molecular weight of 206.29 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(4-fluoro-5-methyl-1,3-thiazol-2-yl)acetamide;molecular hydrogen is sourced from PubChem (CID 154685835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).