(2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite

C6H7FN2O2S — CID 143262570

IUPAC(2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite
SMILESCC(=O)Nc1nc(COF)cs1
InChIInChI=1S/C6H7FN2O2S/c1-4(10)8-6-9-5(2-11-7)3-12-6/h3H,2H2,1H3,(H,8,9,10)
InChIKeyMPCSKEDKEIKLAS-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.50
Rot. Bonds3

About (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite

(2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite (PubChem CID 143262570) has the molecular formula C6H7FN2O2S and a molecular weight of 190.20 g/mol. Its IUPAC name is (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite.

Molecular Properties

Compound Name(2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite
PubChem CID143262570
Molecular FormulaC6H7FN2O2S
Molecular Weight190.20 g/mol
Exact Mass190.02
IUPAC Name(2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite
SMILESCC(=O)Nc1nc(COF)cs1
InChIInChI=1S/C6H7FN2O2S/c1-4(10)8-6-9-5(2-11-7)3-12-6/h3H,2H2,1H3,(H,8,9,10)
InChIKeyMPCSKEDKEIKLAS-UHFFFAOYSA-N
XLogP1.50
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite?
The IUPAC name of (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite (CID 143262570) is (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite.
What is the SMILES notation for (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite?
The canonical SMILES for (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite is CC(=O)Nc1nc(COF)cs1.
What is the InChIKey of (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite?
The InChIKey is MPCSKEDKEIKLAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O2S/c1-4(10)8-6-9-5(2-11-7)3-12-6/h3H,2H2,1H3,(H,8,9,10).
What are the key properties of (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite?
(2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite has a molecular weight of 190.20 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-acetamido-1,3-thiazol-4-yl)methyl hypofluorite is sourced from PubChem (CID 143262570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).