N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide

C12H10FN3O2 — CID 103600396

IUPACN-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1ccc(=O)[nH]n1
InChIInChI=1S/C12H10FN3O2/c1-7-2-3-8(13)6-10(7)14-12(18)9-4-5-11(17)16-15-9/h2-6H,1H3,(H,14,18)(H,16,17)
InChIKeyXWGAZKHAXGGRHQ-UHFFFAOYSA-N
MW247.23 g/mol
LogP1.47
Rot. Bonds2

About N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide

N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 103600396) has the molecular formula C12H10FN3O2 and a molecular weight of 247.23 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID103600396
Molecular FormulaC12H10FN3O2
Molecular Weight247.23 g/mol
Exact Mass247.08
IUPAC NameN-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1ccc(=O)[nH]n1
InChIInChI=1S/C12H10FN3O2/c1-7-2-3-8(13)6-10(7)14-12(18)9-4-5-11(17)16-15-9/h2-6H,1H3,(H,14,18)(H,16,17)
InChIKeyXWGAZKHAXGGRHQ-UHFFFAOYSA-N
XLogP1.47
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.23
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 31456332
N-(4-fluoro-2-iodophenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 103737179
N-(5-fluoro-2-methylphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 47245202
N-(3,5-difluorophenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 103605944
N-(5-fluoro-2-methylphenyl)-5-methyl-1-(6-oxo-1H-pyridazin-3-yl)pyrazole-4-carboxamide
CID 86919857
N-(5-fluoro-2-methylphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62166760
6-oxo-N-(2,4,5-trichlorophenyl)-1H-pyridazine-3-carboxamide
CID 103603355
5-cyano-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
CID 55229412
N-(3-amino-5-fluorophenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 114040790
4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
CID 62155744
N-(4-cyano-2-fluorophenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 103822749
2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 55116155

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide (CID 103600396) is N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide is Cc1ccc(F)cc1NC(=O)c1ccc(=O)[nH]n1.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is XWGAZKHAXGGRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3O2/c1-7-2-3-8(13)6-10(7)14-12(18)9-4-5-11(17)16-15-9/h2-6H,1H3,(H,14,18)(H,16,17).
What are the key properties of N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide?
N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 247.23 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 103600396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).