N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide

C11H8IN3O2 — CID 65098497

IUPACN-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc(I)cn1)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H8IN3O2/c12-8-2-3-9(13-6-8)15-11(17)7-1-4-10(16)14-5-7/h1-6H,(H,14,16)(H,13,15,17)
InChIKeyPHHQEKNITPTGOD-UHFFFAOYSA-N
MW341.11 g/mol
LogP1.63
Rot. Bonds2

About N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide

N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 65098497) has the molecular formula C11H8IN3O2 and a molecular weight of 341.11 g/mol. Its IUPAC name is N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID65098497
Molecular FormulaC11H8IN3O2
Molecular Weight341.11 g/mol
Exact Mass340.97
IUPAC NameN-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc(I)cn1)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H8IN3O2/c12-8-2-3-9(13-6-8)15-11(17)7-1-4-10(16)14-5-7/h1-6H,(H,14,16)(H,13,15,17)
InChIKeyPHHQEKNITPTGOD-UHFFFAOYSA-N
XLogP1.63
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.11
LogP ≤ 51.63
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

3,5-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 65098988
N-(2-bromo-5-iodophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 113231003
N-(5-iodo-2-pyridinyl)naphthalene-2-carboxamide
CID 60674580
N-(5-bromo-2-pyridinyl)-4-iodobenzamide
CID 4066488
N-(1H-imidazol-2-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 60968095
N-(6-chloro-3-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide
CID 78929856
N-(4,6-dichloropyrimidin-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 114074381
N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 47287779
2,6-dichloro-N-(5-iodo-2-pyridinyl)benzamide
CID 23440185
N-(4-carbamothioyl-1H-pyrazol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 114040825
3-cyano-N-(5-iodo-2-pyridinyl)benzamide
CID 65098930
3,4,5-triethoxy-N-(5-iodo-2-pyridinyl)benzamide
CID 2232052

Frequently Asked Questions

What is the IUPAC name of N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide (CID 65098497) is N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide is O=C(Nc1ccc(I)cn1)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is PHHQEKNITPTGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8IN3O2/c12-8-2-3-9(13-6-8)15-11(17)7-1-4-10(16)14-5-7/h1-6H,(H,14,16)(H,13,15,17).
What are the key properties of N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide?
N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 341.11 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-iodo-2-pyridinyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 65098497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).