3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide

C11H8IN3O2 — CID 81443318

IUPAC3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(I)cn1)c1ccncc1O
InChIInChI=1S/C11H8IN3O2/c12-7-1-2-10(14-5-7)15-11(17)8-3-4-13-6-9(8)16/h1-6,16H,(H,14,15,17)
InChIKeyJOGASCWDAKMKSE-UHFFFAOYSA-N
MW341.11 g/mol
LogP2.04
Rot. Bonds2

About 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide

3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide (PubChem CID 81443318) has the molecular formula C11H8IN3O2 and a molecular weight of 341.11 g/mol. Its IUPAC name is 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide
PubChem CID81443318
Molecular FormulaC11H8IN3O2
Molecular Weight341.11 g/mol
Exact Mass340.97
IUPAC Name3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(I)cn1)c1ccncc1O
InChIInChI=1S/C11H8IN3O2/c12-7-1-2-10(14-5-7)15-11(17)8-3-4-13-6-9(8)16/h1-6,16H,(H,14,15,17)
InChIKeyJOGASCWDAKMKSE-UHFFFAOYSA-N
XLogP2.04
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.11
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide (CID 81443318) is 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide is O=C(Nc1ccc(I)cn1)c1ccncc1O.
What is the InChIKey of 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide?
The InChIKey is JOGASCWDAKMKSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8IN3O2/c12-7-1-2-10(14-5-7)15-11(17)8-3-4-13-6-9(8)16/h1-6,16H,(H,14,15,17).
What are the key properties of 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide?
3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide has a molecular weight of 341.11 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(5-iodo-2-pyridinyl)pyridine-4-carboxamide is sourced from PubChem (CID 81443318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).