N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide

C11H9F2N3O2S — CID 60791459

IUPACN-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide
SMILESNc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)cn1
InChIInChI=1S/C11H9F2N3O2S/c12-7-3-8(13)5-10(4-7)19(17,18)16-9-1-2-11(14)15-6-9/h1-6,16H,(H2,14,15)
InChIKeyBKFWGBXJCOQZOQ-UHFFFAOYSA-N
MW285.28 g/mol
LogP1.74
Rot. Bonds3

About N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide

N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide (PubChem CID 60791459) has the molecular formula C11H9F2N3O2S and a molecular weight of 285.28 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide
PubChem CID60791459
Molecular FormulaC11H9F2N3O2S
Molecular Weight285.28 g/mol
Exact Mass285.04
IUPAC NameN-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide
SMILESNc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)cn1
InChIInChI=1S/C11H9F2N3O2S/c12-7-3-8(13)5-10(4-7)19(17,18)16-9-1-2-11(14)15-6-9/h1-6,16H,(H2,14,15)
InChIKeyBKFWGBXJCOQZOQ-UHFFFAOYSA-N
XLogP1.74
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.28
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 113259712
N-(6-amino-3-pyridinyl)-3,5-dichlorobenzenesulfonamide
CID 55025804
N-(6-amino-3-pyridinyl)-2-bromo-4-fluorobenzenesulfonamide
CID 60824210
N-(3-amino-4-fluorophenyl)-3,5-difluorobenzenesulfonamide
CID 43604908
N-(6-amino-3-pyridinyl)-3-bromo-4-chlorobenzenesulfonamide
CID 106606554
N-(4-amino-3-methylphenyl)-3,5-difluorobenzenesulfonamide
CID 43604849
6-amino-N-(4-chloro-3-fluorophenyl)pyridine-3-sulfonamide
CID 62151485
N-(6-amino-3-pyridinyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 60791769
3,5-difluoro-N-[4-(methylamino)phenyl]benzenesulfonamide
CID 43604154
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
CID 62149708
N-(5-bromo-6-chloro-3-pyridinyl)-3,5-difluorobenzenesulfonamide
CID 104826709
N-(6-amino-3-pyridinyl)methanesulfonamide;hydrochloride
CID 155970466

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide (CID 60791459) is N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide is Nc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)cn1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide?
The InChIKey is BKFWGBXJCOQZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2N3O2S/c12-7-3-8(13)5-10(4-7)19(17,18)16-9-1-2-11(14)15-6-9/h1-6,16H,(H2,14,15).
What are the key properties of N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide?
N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide has a molecular weight of 285.28 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide is sourced from PubChem (CID 60791459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).