8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide

C16H13FN2O3S — CID 31914288

IUPAC8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(F)c3ncccc23)cc1
InChIInChI=1S/C16H13FN2O3S/c1-22-12-6-4-11(5-7-12)19-23(20,21)15-9-8-14(17)16-13(15)3-2-10-18-16/h2-10,19H,1H3
InChIKeyGNSRSLXPGVGPGG-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.18
Rot. Bonds4

About 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide

8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide (PubChem CID 31914288) has the molecular formula C16H13FN2O3S and a molecular weight of 332.36 g/mol. Its IUPAC name is 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide.

Molecular Properties

Compound Name8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide
PubChem CID31914288
Molecular FormulaC16H13FN2O3S
Molecular Weight332.36 g/mol
Exact Mass332.06
IUPAC Name8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(F)c3ncccc23)cc1
InChIInChI=1S/C16H13FN2O3S/c1-22-12-6-4-11(5-7-12)19-23(20,21)15-9-8-14(17)16-13(15)3-2-10-18-16/h2-10,19H,1H3
InChIKeyGNSRSLXPGVGPGG-UHFFFAOYSA-N
XLogP3.18
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-methoxy-N-(4-methoxyphenyl)quinoline-5-sulfonamide
CID 729403
8-fluoro-N-(2-methoxy-4-methylphenyl)quinoline-5-sulfonamide
CID 60534314
8-fluoro-N-[4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]phenyl]quinoline-5-sulfonamide
CID 166184474
8-fluoro-N-[3-(trifluoromethyl)phenyl]quinoline-5-sulfonamide
CID 39824401
N-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridine-3-sulfonamide
CID 53174001
3-[(8-fluoroquinolin-5-yl)sulfonylamino]benzoic acid
CID 39824436
8-fluoro-N-(1-methylpyrazol-3-yl)quinoline-5-sulfonamide
CID 31914993
N-[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]-8-fluoroquinoline-5-sulfonamide
CID 60532006
N-[4-(azepan-1-ylsulfonyl)phenyl]-8-methoxyquinoline-5-sulfonamide
CID 167755588
2,3,4,5-tetrafluoro-N-(4-methoxyphenyl)benzenesulfonamide
CID 15485024
N-(4-methoxyphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103303586
5-fluoro-2-[(8-fluoroquinolin-5-yl)sulfonylamino]benzoic acid
CID 55676538

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide?
The IUPAC name of 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide (CID 31914288) is 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide.
What is the SMILES notation for 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide?
The canonical SMILES for 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide is COc1ccc(NS(=O)(=O)c2ccc(F)c3ncccc23)cc1.
What is the InChIKey of 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide?
The InChIKey is GNSRSLXPGVGPGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O3S/c1-22-12-6-4-11(5-7-12)19-23(20,21)15-9-8-14(17)16-13(15)3-2-10-18-16/h2-10,19H,1H3.
What are the key properties of 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide?
8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide has a molecular weight of 332.36 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-N-(4-methoxyphenyl)quinoline-5-sulfonamide is sourced from PubChem (CID 31914288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).