6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide

C11H7ClIN3O — CID 54927074

IUPAC6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1I)c1ccc(Cl)nn1
InChIInChI=1S/C11H7ClIN3O/c12-10-6-5-9(15-16-10)11(17)14-8-4-2-1-3-7(8)13/h1-6H,(H,14,17)
InChIKeyGJQWABSOQMMOGU-UHFFFAOYSA-N
MW359.55 g/mol
LogP2.99
Rot. Bonds2

About 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide

6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide (PubChem CID 54927074) has the molecular formula C11H7ClIN3O and a molecular weight of 359.55 g/mol. Its IUPAC name is 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide
PubChem CID54927074
Molecular FormulaC11H7ClIN3O
Molecular Weight359.55 g/mol
Exact Mass358.93
IUPAC Name6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1I)c1ccc(Cl)nn1
InChIInChI=1S/C11H7ClIN3O/c12-10-6-5-9(15-16-10)11(17)14-8-4-2-1-3-7(8)13/h1-6H,(H,14,17)
InChIKeyGJQWABSOQMMOGU-UHFFFAOYSA-N
XLogP2.99
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.55
LogP ≤ 52.99
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

6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide
CID 55042020
6-chloro-N-(2-ethylphenyl)pyridazine-3-carboxamide
CID 60859186
6-hydrazinyl-N-(2-iodophenyl)pyridazine-3-carboxamide
CID 62243106
6-chloro-N-(2-methoxyphenyl)pyridazine-3-carboxamide
CID 60859833
6-chloro-N-(2-pyrazol-1-ylphenyl)pyridazine-3-carboxamide
CID 61041740
6-chloro-N-(3-chloro-2-methylphenyl)pyridazine-3-carboxamide
CID 54927236
6-chloro-N-(2-chloro-4-iodophenyl)pyridazine-3-carboxamide
CID 61052994
N-(2-iodophenyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62167021
N-(2-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31700169
6-chloropyridazine-3-carbohydrazide
CID 10080848
N-(4-acetamidophenyl)-6-chloropyridazine-3-carboxamide
CID 60859038
6-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]pyridazine-3-carboxamide
CID 61217247

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide (CID 54927074) is 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide is O=C(Nc1ccccc1I)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide?
The InChIKey is GJQWABSOQMMOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClIN3O/c12-10-6-5-9(15-16-10)11(17)14-8-4-2-1-3-7(8)13/h1-6H,(H,14,17).
What are the key properties of 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide?
6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide has a molecular weight of 359.55 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 54927074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).