N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide

C13H14FN3O2S — CID 62143380

IUPACN-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)Nc2cc(C)ccc2F)ccn1
InChIInChI=1S/C13H14FN3O2S/c1-9-3-4-11(14)12(7-9)17-20(18,19)10-5-6-16-13(8-10)15-2/h3-8,17H,1-2H3,(H,15,16)
InChIKeyVXCROCWCQYMQOR-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.37
Rot. Bonds4

About N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide

N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide (PubChem CID 62143380) has the molecular formula C13H14FN3O2S and a molecular weight of 295.34 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
PubChem CID62143380
Molecular FormulaC13H14FN3O2S
Molecular Weight295.34 g/mol
Exact Mass295.08
IUPAC NameN-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)Nc2cc(C)ccc2F)ccn1
InChIInChI=1S/C13H14FN3O2S/c1-9-3-4-11(14)12(7-9)17-20(18,19)10-5-6-16-13(8-10)15-2/h3-8,17H,1-2H3,(H,15,16)
InChIKeyVXCROCWCQYMQOR-UHFFFAOYSA-N
XLogP2.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluoro-2-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62144375
N-(4-fluoro-3-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62811577
2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
CID 55044083
N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61004704
2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
CID 62143731
N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62148302
N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62148688
N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62143202
N-(2-fluoro-5-methylphenyl)-2-hydrazinylpyrimidine-5-sulfonamide
CID 61327363
2-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-sulfonamide
CID 54896062
4-amino-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 28968050
4-fluoro-3-methyl-N-(4-methyl-2-pyridinyl)benzenesulfonamide
CID 850130

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide (CID 62143380) is N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)Nc2cc(C)ccc2F)ccn1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide?
The InChIKey is VXCROCWCQYMQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3O2S/c1-9-3-4-11(14)12(7-9)17-20(18,19)10-5-6-16-13(8-10)15-2/h3-8,17H,1-2H3,(H,15,16).
What are the key properties of N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide?
N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide has a molecular weight of 295.34 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide is sourced from PubChem (CID 62143380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).