2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide

C7H9FN2O2S — CID 131110429

IUPAC2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCONC(=O)C(F)c1nc(C)cs1
InChIInChI=1S/C7H9FN2O2S/c1-4-3-13-7(9-4)5(8)6(11)10-12-2/h3,5H,1-2H3,(H,10,11)
InChIKeyCHOFJRXUMOLSNA-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.14
Rot. Bonds3

About 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide

2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 131110429) has the molecular formula C7H9FN2O2S and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID131110429
Molecular FormulaC7H9FN2O2S
Molecular Weight204.23 g/mol
Exact Mass204.04
IUPAC Name2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCONC(=O)C(F)c1nc(C)cs1
InChIInChI=1S/C7H9FN2O2S/c1-4-3-13-7(9-4)5(8)6(11)10-12-2/h3,5H,1-2H3,(H,10,11)
InChIKeyCHOFJRXUMOLSNA-UHFFFAOYSA-N
XLogP1.14
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide (CID 131110429) is 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide is CONC(=O)C(F)c1nc(C)cs1.
What is the InChIKey of 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is CHOFJRXUMOLSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O2S/c1-4-3-13-7(9-4)5(8)6(11)10-12-2/h3,5H,1-2H3,(H,10,11).
What are the key properties of 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 204.23 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methoxy-2-(4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 131110429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).