N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide

C12H10ClFN2O3S — CID 6473185

IUPACN-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide
SMILESCOc1ccc(F)cc1S(=O)(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C12H10ClFN2O3S/c1-19-10-4-3-9(14)6-11(10)20(17,18)16-12-5-2-8(13)7-15-12/h2-7H,1H3,(H,15,16)
InChIKeyFOVITHHZTPRAHC-UHFFFAOYSA-N
MW316.74 g/mol
LogP2.68
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide

N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide (PubChem CID 6473185) has the molecular formula C12H10ClFN2O3S and a molecular weight of 316.74 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide
PubChem CID6473185
Molecular FormulaC12H10ClFN2O3S
Molecular Weight316.74 g/mol
Exact Mass316.01
IUPAC NameN-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide
SMILESCOc1ccc(F)cc1S(=O)(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C12H10ClFN2O3S/c1-19-10-4-3-9(14)6-11(10)20(17,18)16-12-5-2-8(13)7-15-12/h2-7H,1H3,(H,15,16)
InChIKeyFOVITHHZTPRAHC-UHFFFAOYSA-N
XLogP2.68
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.74
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(5-chloro-2-pyridinyl)-2-methoxybenzenesulfonamide
CID 839351
N-(4-chlorophenyl)-5-fluoro-2-methoxybenzenesulfonamide
CID 41446937
N-(5-chloro-2-pyridinyl)-2-ethoxy-4,5-dimethylbenzenesulfonamide
CID 6473352
N-(3,4-difluorophenyl)-5-fluoro-2-methoxybenzenesulfonamide
CID 28560651
5-tert-butyl-N-(5-chloro-2-pyridinyl)-2-ethoxybenzenesulfonamide
CID 7574330
5-amino-N-(5-fluoro-2-pyridinyl)-2-methoxy-4-methylbenzenesulfonamide
CID 79959391
5-chloro-2-methoxy-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 3476038
N-(2,3-dichlorophenyl)-5-fluoro-2-methoxybenzenesulfonamide
CID 1256564
5-chloro-N-[2-(dimethylamino)-5-fluorophenyl]-2-methoxybenzenesulfonamide
CID 113092578
N-[5-(2-fluoroanilino)-2-pyridinyl]-2-methoxy-5-methylbenzenesulfonamide
CID 113033057
N-(5-chloro-2-pyridinyl)-3,4-difluorobenzenesulfonamide
CID 19683191
5-[(5-chloro-2-pyridinyl)sulfamoyl]-2-methoxy-N-methylbenzamide
CID 6471703

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide (CID 6473185) is N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide is COc1ccc(F)cc1S(=O)(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide?
The InChIKey is FOVITHHZTPRAHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClFN2O3S/c1-19-10-4-3-9(14)6-11(10)20(17,18)16-12-5-2-8(13)7-15-12/h2-7H,1H3,(H,15,16).
What are the key properties of N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide?
N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide has a molecular weight of 316.74 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-5-fluoro-2-methoxybenzenesulfonamide is sourced from PubChem (CID 6473185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).