4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide

C6H5F2IN2O3S — CID 118851891

IUPAC4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1c(C(F)F)c(I)c[nH]c1=O
InChIInChI=1S/C6H5F2IN2O3S/c7-5(8)3-2(9)1-11-6(12)4(3)15(10,13)14/h1,5H,(H,11,12)(H2,10,13,14)
InChIKeyOYUSJZWNBOGRQS-UHFFFAOYSA-N
MW350.08 g/mol
LogP0.56
Rot. Bonds2

About 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide

4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide (PubChem CID 118851891) has the molecular formula C6H5F2IN2O3S and a molecular weight of 350.08 g/mol. Its IUPAC name is 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide
PubChem CID118851891
Molecular FormulaC6H5F2IN2O3S
Molecular Weight350.08 g/mol
Exact Mass349.90
IUPAC Name4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1c(C(F)F)c(I)c[nH]c1=O
InChIInChI=1S/C6H5F2IN2O3S/c7-5(8)3-2(9)1-11-6(12)4(3)15(10,13)14/h1,5H,(H,11,12)(H2,10,13,14)
InChIKeyOYUSJZWNBOGRQS-UHFFFAOYSA-N
XLogP0.56
TPSA93.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.08
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

5-bromo-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide
CID 130110670
3-(aminomethyl)-4-(difluoromethyl)-5-iodo-1H-pyridin-2-one
CID 130082587
5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide
CID 130077089
3-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-4-carbaldehyde
CID 130082829
4-(difluoromethyl)-5-fluoro-2-oxo-1H-pyridine-3-sulfonyl chloride
CID 118852230
2-(difluoromethyl)-5-hydroxy-4-oxo-1H-pyridine-3-sulfonamide
CID 130100388
5-(aminomethyl)-4-(difluoromethyl)-3-iodo-1H-pyridin-2-one
CID 130082592
4-(difluoromethyl)-5-fluoro-3-iodo-1H-pyridin-2-one
CID 118812570
5-amino-4-(difluoromethyl)-6-oxo-1H-pyridine-3-sulfonyl chloride
CID 130105066
5-amino-4-(difluoromethyl)-2-iodopyridine-3-sulfonamide
CID 130105762
3-(difluoromethyl)-5-iodo-2-(trifluoromethyl)-1H-pyridin-4-one
CID 130082730
6-chloro-4-(difluoromethyl)-2-oxo-1H-pyridine-3-sulfonamide
CID 130072899

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide (CID 118851891) is 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide is NS(=O)(=O)c1c(C(F)F)c(I)c[nH]c1=O.
What is the InChIKey of 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is OYUSJZWNBOGRQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2IN2O3S/c7-5(8)3-2(9)1-11-6(12)4(3)15(10,13)14/h1,5H,(H,11,12)(H2,10,13,14).
What are the key properties of 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide?
4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 350.08 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 118851891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).