N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide

C12H11ClFN3O2S — CID 103304303

IUPACN-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1ccc(F)cc1Cl
InChIInChI=1S/C12H11ClFN3O2S/c1-15-11-3-2-6-16-12(11)20(18,19)17-10-5-4-8(14)7-9(10)13/h2-7,15,17H,1H3
InChIKeyJPZVDVIFRDAJHP-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.72
Rot. Bonds4

About N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide

N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide (PubChem CID 103304303) has the molecular formula C12H11ClFN3O2S and a molecular weight of 315.76 g/mol. Its IUPAC name is N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide
PubChem CID103304303
Molecular FormulaC12H11ClFN3O2S
Molecular Weight315.76 g/mol
Exact Mass315.02
IUPAC NameN-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1ccc(F)cc1Cl
InChIInChI=1S/C12H11ClFN3O2S/c1-15-11-3-2-6-16-12(11)20(18,19)17-10-5-4-8(14)7-9(10)13/h2-7,15,17H,1H3
InChIKeyJPZVDVIFRDAJHP-UHFFFAOYSA-N
XLogP2.72
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.72
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-(2-chloro-4-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304236
N-(5-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304023
3-amino-N-(2-chloro-4-fluorophenyl)pyridine-2-sulfonamide
CID 103304304
N-(2,6-dichloro-4-fluorophenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301917
N-(3-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305047
3-(methylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303450
N-(4-fluoro-2-methylphenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300908
N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304016
N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304014
N-(4-bromo-3-chlorophenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 107616509
3-amino-N-(2-chloro-5-fluorophenyl)pyridine-2-sulfonamide
CID 107531133

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide (CID 103304303) is N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)Nc1ccc(F)cc1Cl.
What is the InChIKey of N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide?
The InChIKey is JPZVDVIFRDAJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClFN3O2S/c1-15-11-3-2-6-16-12(11)20(18,19)17-10-5-4-8(14)7-9(10)13/h2-7,15,17H,1H3.
What are the key properties of N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide?
N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide has a molecular weight of 315.76 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-fluorophenyl)-3-(methylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103304303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).