6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide

C13H14ClN3O2S — CID 64608503

IUPAC6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide
SMILESCCc1ccc(NS(=O)(=O)c2cnc(N)c(Cl)c2)cc1
InChIInChI=1S/C13H14ClN3O2S/c1-2-9-3-5-10(6-4-9)17-20(18,19)11-7-12(14)13(15)16-8-11/h3-8,17H,2H2,1H3,(H2,15,16)
InChIKeySCMIAXCEPFYSQY-UHFFFAOYSA-N
MW311.79 g/mol
LogP2.68
Rot. Bonds4

About 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide

6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide (PubChem CID 64608503) has the molecular formula C13H14ClN3O2S and a molecular weight of 311.79 g/mol. Its IUPAC name is 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide
PubChem CID64608503
Molecular FormulaC13H14ClN3O2S
Molecular Weight311.79 g/mol
Exact Mass311.05
IUPAC Name6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide
SMILESCCc1ccc(NS(=O)(=O)c2cnc(N)c(Cl)c2)cc1
InChIInChI=1S/C13H14ClN3O2S/c1-2-9-3-5-10(6-4-9)17-20(18,19)11-7-12(14)13(15)16-8-11/h3-8,17H,2H2,1H3,(H2,15,16)
InChIKeySCMIAXCEPFYSQY-UHFFFAOYSA-N
XLogP2.68
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.79
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(4-ethylphenyl)pyrimidine-5-sulfonamide
CID 62142790
6-amino-5-chloro-N-(3-fluorophenyl)pyridine-3-sulfonamide
CID 64608125
6-amino-5-chloro-N-(2-methylpropyl)pyridine-3-sulfonamide
CID 64607743
6-amino-5-chloro-N-(2-methylbutyl)pyridine-3-sulfonamide
CID 64601703
6-amino-5-chloro-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 64608701
6-amino-5-chloro-N',N'-dimethylpyridine-3-sulfonohydrazide
CID 83023337
6-amino-5-chloro-N-(3-chloro-2-methylphenyl)pyridine-3-sulfonamide
CID 64606596
6-amino-5-methyl-N-(4-methylphenyl)pyridine-3-sulfonamide
CID 98020919
6-amino-5-chloro-N-(4-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 64601518
6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide
CID 64602240
6-amino-5-chloro-N-(2-chloro-4,6-difluorophenyl)pyridine-3-sulfonamide
CID 83074226
6-amino-5-chloro-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-sulfonamide
CID 64608128

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide (CID 64608503) is 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide is CCc1ccc(NS(=O)(=O)c2cnc(N)c(Cl)c2)cc1.
What is the InChIKey of 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide?
The InChIKey is SCMIAXCEPFYSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O2S/c1-2-9-3-5-10(6-4-9)17-20(18,19)11-7-12(14)13(15)16-8-11/h3-8,17H,2H2,1H3,(H2,15,16).
What are the key properties of 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide?
6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide has a molecular weight of 311.79 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-(4-ethylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64608503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).