3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide

C17H14FN5O4S — CID 178030232

IUPAC3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ncccc3F)cc2)nn1
InChIInChI=1S/C17H14FN5O4S/c1-27-15-9-8-14(21-22-15)23-28(25,26)12-6-4-11(5-7-12)20-17(24)16-13(18)3-2-10-19-16/h2-10H,1H3,(H,20,24)(H,21,23)
InChIKeyICOCUAPBLSLIMU-UHFFFAOYSA-N
MW403.40 g/mol
LogP2.07
Rot. Bonds6

About 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide

3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide (PubChem CID 178030232) has the molecular formula C17H14FN5O4S and a molecular weight of 403.40 g/mol. Its IUPAC name is 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide
PubChem CID178030232
Molecular FormulaC17H14FN5O4S
Molecular Weight403.40 g/mol
Exact Mass403.08
IUPAC Name3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ncccc3F)cc2)nn1
InChIInChI=1S/C17H14FN5O4S/c1-27-15-9-8-14(21-22-15)23-28(25,26)12-6-4-11(5-7-12)20-17(24)16-13(18)3-2-10-19-16/h2-10H,1H3,(H,20,24)(H,21,23)
InChIKeyICOCUAPBLSLIMU-UHFFFAOYSA-N
XLogP2.07
TPSA123.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.40
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The IUPAC name of 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide (CID 178030232) is 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The canonical SMILES for 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide is COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ncccc3F)cc2)nn1.
What is the InChIKey of 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?
The InChIKey is ICOCUAPBLSLIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN5O4S/c1-27-15-9-8-14(21-22-15)23-28(25,26)12-6-4-11(5-7-12)20-17(24)16-13(18)3-2-10-19-16/h2-10H,1H3,(H,20,24)(H,21,23).
What are the key properties of 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide?
3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide has a molecular weight of 403.40 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[4-[(6-methoxypyridazin-3-yl)sulfamoyl]phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 178030232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).