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

C11H9IN4O — CID 55042020

IUPAC6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide
SMILESNc1ccc(C(=O)Nc2ccccc2I)nn1
InChIInChI=1S/C11H9IN4O/c12-7-3-1-2-4-8(7)14-11(17)9-5-6-10(13)16-15-9/h1-6H,(H2,13,16)(H,14,17)
InChIKeyMJGCMRDFVOVOAB-UHFFFAOYSA-N
MW340.12 g/mol
LogP1.92
Rot. Bonds2

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

6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide (PubChem CID 55042020) has the molecular formula C11H9IN4O and a molecular weight of 340.12 g/mol. Its IUPAC name is 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide
PubChem CID55042020
Molecular FormulaC11H9IN4O
Molecular Weight340.12 g/mol
Exact Mass339.98
IUPAC Name6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide
SMILESNc1ccc(C(=O)Nc2ccccc2I)nn1
InChIInChI=1S/C11H9IN4O/c12-7-3-1-2-4-8(7)14-11(17)9-5-6-10(13)16-15-9/h1-6H,(H2,13,16)(H,14,17)
InChIKeyMJGCMRDFVOVOAB-UHFFFAOYSA-N
XLogP1.92
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.12
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-(2-iodophenyl)pyridazine-3-carboxamide
CID 54927074
6-hydrazinyl-N-(2-iodophenyl)pyridazine-3-carboxamide
CID 62243106
6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
CID 55043296
6-amino-N-(2,3-difluorophenyl)pyridazine-3-carboxamide
CID 55041797
6-amino-N-(2-iodophenyl)pyrazine-2-carboxamide
CID 114035710
N-(2-iodophenyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62167021
6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide
CID 62155166
N-(2-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31700169
6-amino-N-(2,4-dibromophenyl)pyridazine-3-carboxamide
CID 62187350
2-amino-6-chloro-N-(2-iodophenyl)pyridine-4-carboxamide
CID 62154227
6-amino-N-(4-fluorophenyl)pyridazine-3-carboxamide
CID 62155228
4-amino-N-(2-iodophenyl)quinoline-2-carboxamide
CID 63375620

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide (CID 55042020) is 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide is Nc1ccc(C(=O)Nc2ccccc2I)nn1.
What is the InChIKey of 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide?
The InChIKey is MJGCMRDFVOVOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9IN4O/c12-7-3-1-2-4-8(7)14-11(17)9-5-6-10(13)16-15-9/h1-6H,(H2,13,16)(H,14,17).
What are the key properties of 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide?
6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide has a molecular weight of 340.12 g/mol, XLogP of 1.92, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-iodophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 55042020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).