4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide

C14H16N2O3S — CID 79240556

IUPAC4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccc(C(C)O)cc2)ccn1
InChIInChI=1S/C14H16N2O3S/c1-10-9-13(7-8-15-10)16-20(18,19)14-5-3-12(4-6-14)11(2)17/h3-9,11,17H,1-2H3,(H,15,16)
InChIKeyJXZAHWJPOHCENB-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.24
Rot. Bonds4

About 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide

4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide (PubChem CID 79240556) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide
PubChem CID79240556
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide
SMILESCc1cc(NS(=O)(=O)c2ccc(C(C)O)cc2)ccn1
InChIInChI=1S/C14H16N2O3S/c1-10-9-13(7-8-15-10)16-20(18,19)14-5-3-12(4-6-14)11(2)17/h3-9,11,17H,1-2H3,(H,15,16)
InChIKeyJXZAHWJPOHCENB-UHFFFAOYSA-N
XLogP2.24
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,6-dimethylpyrimidin-2-yl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 43507234
N-(2-methyl-4-pyridinyl)-4-propylbenzenesulfonamide
CID 110757506
4-(1-hydroxyethyl)-N-phenylbenzenesulfonamide
CID 43507245
3-methyl-N-(2-methyl-4-pyridinyl)-4-propan-2-yloxybenzenesulfonamide
CID 110758191
6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
CID 79240478
3-(aminomethyl)-4-ethyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 106071272
2-hydrazinyl-N-(2-methyl-4-pyridinyl)pyrimidine-5-sulfonamide
CID 79241040
methyl 2-iodo-5-[(2-methyl-4-pyridinyl)sulfamoyl]benzoate
CID 75449151
N-(2-methyl-4-pyridinyl)-3-nitrobenzenesulfonamide
CID 110756916
N-[4-(1-hydroxyethyl)phenyl]-3-methylbenzenesulfonamide
CID 43508584
N-(2,4-dimethylphenyl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 43507393
2-methyl-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 78955887

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide (CID 79240556) is 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide is Cc1cc(NS(=O)(=O)c2ccc(C(C)O)cc2)ccn1.
What is the InChIKey of 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
The InChIKey is JXZAHWJPOHCENB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-10-9-13(7-8-15-10)16-20(18,19)14-5-3-12(4-6-14)11(2)17/h3-9,11,17H,1-2H3,(H,15,16).
What are the key properties of 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide?
4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide has a molecular weight of 292.36 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxyethyl)-N-(2-methyl-4-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 79240556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).