N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide

C17H15FN2O4S — CID 164876932

IUPACN-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide
SMILESCOc1cc(OC)cc(S(=O)(=O)Nc2cc(F)cc3cccnc23)c1
InChIInChI=1S/C17H15FN2O4S/c1-23-13-8-14(24-2)10-15(9-13)25(21,22)20-16-7-12(18)6-11-4-3-5-19-17(11)16/h3-10,20H,1-2H3
InChIKeyGQQVTZIEIATMNJ-UHFFFAOYSA-N
MW362.38 g/mol
LogP3.19
Rot. Bonds5

About N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide

N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide (PubChem CID 164876932) has the molecular formula C17H15FN2O4S and a molecular weight of 362.38 g/mol. Its IUPAC name is N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide
PubChem CID164876932
Molecular FormulaC17H15FN2O4S
Molecular Weight362.38 g/mol
Exact Mass362.07
IUPAC NameN-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide
SMILESCOc1cc(OC)cc(S(=O)(=O)Nc2cc(F)cc3cccnc23)c1
InChIInChI=1S/C17H15FN2O4S/c1-23-13-8-14(24-2)10-15(9-13)25(21,22)20-16-7-12(18)6-11-4-3-5-19-17(11)16/h3-10,20H,1-2H3
InChIKeyGQQVTZIEIATMNJ-UHFFFAOYSA-N
XLogP3.19
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-(6-methoxyquinolin-8-yl)benzenesulfonamide
CID 16604844
N-(6-methoxyquinolin-8-yl)benzenesulfonamide
CID 821430
4-fluoro-N-(6-methoxyquinolin-8-yl)-2-methylbenzenesulfonamide
CID 110715545
N-[6-(3,5-difluorophenoxy)quinolin-8-yl]-4-methylbenzenesulfonamide
CID 118873481
N-(6-fluoroquinolin-8-yl)-5-methylpyridine-2-sulfonamide
CID 164876845
5-[(6-methoxyquinolin-8-yl)sulfamoyl]furan-2-carboxylic acid
CID 69058052
4-methoxy-3-methyl-N-(6-methylquinolin-8-yl)benzenesulfonamide
CID 110715588
N-benzo[h]quinolin-10-yl-4-methoxybenzenesulfonamide
CID 102274855
4-methoxy-N-[2-(pyrimidin-2-ylamino)phenyl]benzenesulfonamide
CID 15293859
5-(4-fluorophenyl)-N-(6-methoxyquinolin-8-yl)pyrazolidine-3-carboxamide
CID 75355090
N-(2,5-dimethoxyphenyl)-3,5-dimethoxybenzenesulfonamide
CID 24989180
N-(5-fluoro-2-methylphenyl)-4-methoxybenzenesulfonamide
CID 6470178

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide?
The IUPAC name of N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide (CID 164876932) is N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide.
What is the SMILES notation for N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide?
The canonical SMILES for N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide is COc1cc(OC)cc(S(=O)(=O)Nc2cc(F)cc3cccnc23)c1.
What is the InChIKey of N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide?
The InChIKey is GQQVTZIEIATMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O4S/c1-23-13-8-14(24-2)10-15(9-13)25(21,22)20-16-7-12(18)6-11-4-3-5-19-17(11)16/h3-10,20H,1-2H3.
What are the key properties of N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide?
N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide has a molecular weight of 362.38 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoroquinolin-8-yl)-3,5-dimethoxybenzenesulfonamide is sourced from PubChem (CID 164876932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).