2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide

C22H16FN3O4S — CID 78319528

IUPAC2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
SMILESNS(=O)(=O)c1cccc(NC(=O)c2cc3ccccc3nc2Oc2ccc(F)cc2)c1
InChIInChI=1S/C22H16FN3O4S/c23-15-8-10-17(11-9-15)30-22-19(12-14-4-1-2-7-20(14)26-22)21(27)25-16-5-3-6-18(13-16)31(24,28)29/h1-13H,(H,25,27)(H2,24,28,29)
InChIKeyMRYZLZGEYZDMQS-UHFFFAOYSA-N
MW437.45 g/mol
LogP4.07
Rot. Bonds5

About 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide

2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide (PubChem CID 78319528) has the molecular formula C22H16FN3O4S and a molecular weight of 437.45 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
PubChem CID78319528
Molecular FormulaC22H16FN3O4S
Molecular Weight437.45 g/mol
Exact Mass437.08
IUPAC Name2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
SMILESNS(=O)(=O)c1cccc(NC(=O)c2cc3ccccc3nc2Oc2ccc(F)cc2)c1
InChIInChI=1S/C22H16FN3O4S/c23-15-8-10-17(11-9-15)30-22-19(12-14-4-1-2-7-20(14)26-22)21(27)25-16-5-3-6-18(13-16)31(24,28)29/h1-13H,(H,25,27)(H2,24,28,29)
InChIKeyMRYZLZGEYZDMQS-UHFFFAOYSA-N
XLogP4.07
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.45
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-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-(acetylsulfamoyl)phenyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide
CID 1220214
2-(4-Fluorophenyl)-N-(3-{[(furan-2-yl)methyl]sulfamoyl}phenyl)quinoline-4-carboxamide
CID 5237327
N-cyclohexyl-2-[(4-fluorophenyl)methoxy]quinoline-3-carboxamide
CID 60145373
2-(4-fluoro-2-methoxyphenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319529
2-(3-fluoro-4-methoxyphenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319555
2-(4-fluoro-2-methylphenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319556
2-phenoxy-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319557
2-(2,4-difluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319558
2-(2-chloro-4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319559
N-(3-sulfamoylphenyl)-2-[4-(2,2,2-trifluoroethoxy)phenoxy]quinoline-3-carboxamide
CID 78319560
N-(3-sulfamoylphenyl)-2-[4-(trifluoromethoxy)phenoxy]quinoline-3-carboxamide
CID 78319587
2-(2-chloro-4-methoxyphenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide
CID 78319588

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide (CID 78319528) is 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide is NS(=O)(=O)c1cccc(NC(=O)c2cc3ccccc3nc2Oc2ccc(F)cc2)c1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide?
The InChIKey is MRYZLZGEYZDMQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16FN3O4S/c23-15-8-10-17(11-9-15)30-22-19(12-14-4-1-2-7-20(14)26-22)21(27)25-16-5-3-6-18(13-16)31(24,28)29/h1-13H,(H,25,27)(H2,24,28,29).
What are the key properties of 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide?
2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide has a molecular weight of 437.45 g/mol, XLogP of 4.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(3-sulfamoylphenyl)quinoline-3-carboxamide is sourced from PubChem (CID 78319528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).