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

C13H10I2N2O2 — CID 26536516

IUPAC2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide
SMILESO=C(Cn1cc(I)c(=O)c(I)c1)Nc1ccccc1
InChIInChI=1S/C13H10I2N2O2/c14-10-6-17(7-11(15)13(10)19)8-12(18)16-9-4-2-1-3-5-9/h1-7H,8H2,(H,16,18)
InChIKeyRAZAGPDPOUKXTH-UHFFFAOYSA-N
MW480.04 g/mol
LogP2.70
Rot. Bonds3

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

2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide (PubChem CID 26536516) has the molecular formula C13H10I2N2O2 and a molecular weight of 480.04 g/mol. Its IUPAC name is 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide
PubChem CID26536516
Molecular FormulaC13H10I2N2O2
Molecular Weight480.04 g/mol
Exact Mass479.88
IUPAC Name2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide
SMILESO=C(Cn1cc(I)c(=O)c(I)c1)Nc1ccccc1
InChIInChI=1S/C13H10I2N2O2/c14-10-6-17(7-11(15)13(10)19)8-12(18)16-9-4-2-1-3-5-9/h1-7H,8H2,(H,16,18)
InChIKeyRAZAGPDPOUKXTH-UHFFFAOYSA-N
XLogP2.70
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.04
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide?
The IUPAC name of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide (CID 26536516) is 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide.
What is the SMILES notation for 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide?
The canonical SMILES for 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide is O=C(Cn1cc(I)c(=O)c(I)c1)Nc1ccccc1.
What is the InChIKey of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide?
The InChIKey is RAZAGPDPOUKXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10I2N2O2/c14-10-6-17(7-11(15)13(10)19)8-12(18)16-9-4-2-1-3-5-9/h1-7H,8H2,(H,16,18).
What are the key properties of 2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide?
2-(3,5-diiodo-4-oxo-1-pyridinyl)-N-phenylacetamide has a molecular weight of 480.04 g/mol, XLogP of 2.70, 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-phenylacetamide is sourced from PubChem (CID 26536516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).