N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide

C6H7FN2OS — CID 59293708

IUPACN-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(CF)cs1
InChIInChI=1S/C6H7FN2OS/c1-4(10)8-6-9-5(2-7)3-11-6/h3H,2H2,1H3,(H,8,9,10)
InChIKeyFKQBVKPXCZYXPU-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.57
Rot. Bonds2

About N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide

N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 59293708) has the molecular formula C6H7FN2OS and a molecular weight of 174.20 g/mol. Its IUPAC name is N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide
PubChem CID59293708
Molecular FormulaC6H7FN2OS
Molecular Weight174.20 g/mol
Exact Mass174.03
IUPAC NameN-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(CF)cs1
InChIInChI=1S/C6H7FN2OS/c1-4(10)8-6-9-5(2-7)3-11-6/h3H,2H2,1H3,(H,8,9,10)
InChIKeyFKQBVKPXCZYXPU-UHFFFAOYSA-N
XLogP1.57
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide (CID 59293708) is N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(CF)cs1.
What is the InChIKey of N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is FKQBVKPXCZYXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2OS/c1-4(10)8-6-9-5(2-7)3-11-6/h3H,2H2,1H3,(H,8,9,10).
What are the key properties of N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide?
N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 174.20 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(fluoromethyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 59293708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).