2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide

C13H9FI2N2O2 — CID 26579576

IUPAC2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
SMILESO=C(Cn1cc(I)c(=O)c(I)c1)Nc1cccc(F)c1
InChIInChI=1S/C13H9FI2N2O2/c14-8-2-1-3-9(4-8)17-12(19)7-18-5-10(15)13(20)11(16)6-18/h1-6H,7H2,(H,17,19)
InChIKeyPCFWXQHOIDPWNC-UHFFFAOYSA-N
MW498.03 g/mol
LogP2.84
Rot. Bonds3

About 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide

2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide (PubChem CID 26579576) has the molecular formula C13H9FI2N2O2 and a molecular weight of 498.03 g/mol. Its IUPAC name is 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
PubChem CID26579576
Molecular FormulaC13H9FI2N2O2
Molecular Weight498.03 g/mol
Exact Mass497.87
IUPAC Name2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide
SMILESO=C(Cn1cc(I)c(=O)c(I)c1)Nc1cccc(F)c1
InChIInChI=1S/C13H9FI2N2O2/c14-8-2-1-3-9(4-8)17-12(19)7-18-5-10(15)13(20)11(16)6-18/h1-6H,7H2,(H,17,19)
InChIKeyPCFWXQHOIDPWNC-UHFFFAOYSA-N
XLogP2.84
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.03
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide
CID 26536516
N-(3-fluorophenyl)-2-[3-[1-(methylamino)ethyl]pyrrol-1-yl]acetamide
CID 79099131
N-(3-fluorophenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 9067963
2-chloro-N-(3-fluorophenyl)acetamide
CID 2388931
N-(3-fluorophenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679426
2-(4-chloro-5-iodo-6-oxopyrimidin-1-yl)-N-(3-fluorophenyl)acetamide
CID 114584066
N-(3-fluorophenyl)-2-[3-(1-hydroxybutyl)pyrrol-1-yl]acetamide
CID 79107758
1-[2-(3-fluoroanilino)-2-oxoethyl]pyrazole-4-carboxylic acid
CID 19502590
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(3-fluorophenyl)acetamide
CID 24564807
N-(3-fluorophenyl)-2-(2-methyl-9-oxoacridin-10-yl)acetamide
CID 15993730
2-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]acetic acid
CID 14802232
N-(3-fluorophenyl)-2-(4-methyl-5-oxo-1,2,4-triazol-1-yl)acetamide
CID 115774438

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide (CID 26579576) is 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide is O=C(Cn1cc(I)c(=O)c(I)c1)Nc1cccc(F)c1.
What is the InChIKey of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
The InChIKey is PCFWXQHOIDPWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FI2N2O2/c14-8-2-1-3-9(4-8)17-12(19)7-18-5-10(15)13(20)11(16)6-18/h1-6H,7H2,(H,17,19).
What are the key properties of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide?
2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide has a molecular weight of 498.03 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 26579576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).