N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide

C13H13F2N3O2S — CID 103304014

IUPACN-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C13H13F2N3O2S/c1-2-16-12-4-3-7-17-13(12)21(19,20)18-11-6-5-9(14)8-10(11)15/h3-8,16,18H,2H2,1H3
InChIKeyMGPYDURATUOGGF-UHFFFAOYSA-N
MW313.33 g/mol
LogP2.59
Rot. Bonds5

About N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide

N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide (PubChem CID 103304014) has the molecular formula C13H13F2N3O2S and a molecular weight of 313.33 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
PubChem CID103304014
Molecular FormulaC13H13F2N3O2S
Molecular Weight313.33 g/mol
Exact Mass313.07
IUPAC NameN-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C13H13F2N3O2S/c1-2-16-12-4-3-7-17-13(12)21(19,20)18-11-6-5-9(14)8-10(11)15/h3-8,16,18H,2H2,1H3
InChIKeyMGPYDURATUOGGF-UHFFFAOYSA-N
XLogP2.59
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.33
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-difluorophenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304009
N-(4-chloro-2-iodophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 107630627
3-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-sulfonamide
CID 107642917
N-(2-bromophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303927
N-(2,4-difluorophenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62143667
N-(3-fluorophenyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103303892
N-(4-fluoro-2-methylphenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300908
N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304303
N-(3-bromo-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103306363
N-(5-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304023
N-(2-ethoxyphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299090
N-(4-bromo-2-fluorophenyl)-2-(ethylamino)pyridine-3-sulfonamide
CID 62148877

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide (CID 103304014) is N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
The InChIKey is MGPYDURATUOGGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F2N3O2S/c1-2-16-12-4-3-7-17-13(12)21(19,20)18-11-6-5-9(14)8-10(11)15/h3-8,16,18H,2H2,1H3.
What are the key properties of N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide?
N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide has a molecular weight of 313.33 g/mol, XLogP of 2.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103304014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).