2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide

C14H14N2O3S — CID 3160793

IUPAC2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(NC(=O)CS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C14H14N2O3S/c1-11-7-8-15-13(9-11)16-14(17)10-20(18,19)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,15,16,17)
InChIKeyGQEKKOZDZUZQHA-UHFFFAOYSA-N
MW290.34 g/mol
LogP1.80
Rot. Bonds4

About 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide

2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide (PubChem CID 3160793) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide
PubChem CID3160793
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC Name2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(NC(=O)CS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C14H14N2O3S/c1-11-7-8-15-13(9-11)16-14(17)10-20(18,19)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,15,16,17)
InChIKeyGQEKKOZDZUZQHA-UHFFFAOYSA-N
XLogP1.80
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-Methyl-2-pyridyl)benzenesulfonamide
CID 739341
2-(benzenesulfonyl)-N-(5-chloropyridin-2-yl)acetamide
CID 2985129
N-(6-Methyl-pyridin-2-yl)-2-(toluene-4-sulfonyl)-acetamide
CID 3163423
1-(4-Methylphenyl)sulfonyl-3-(5-methylpyridin-2-yl)urea
CID 4062849
3-[(4-acetamidophenyl)sulfonylamino]-N-(4-methyl-2-pyridinyl)propanamide
CID 24685891
N-(4-methylpyridin-2-yl)thiophene-2-carboxamide
CID 685128
N-{4-[(4-methylpyridin-2-yl)sulfamoyl]phenyl}acetamide
CID 772016
3-(Benzenesulfonyl)-7-methyl-2-[(5-methyl-2-pyridinyl)imino]pyrido[1,2-a]pyrimidin-4-amine
CID 10341241
N-{4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl}acetamide
CID 1118249
N1-(4-methyl-2-pyridyl)-2-(2-pyridylthio)acetamide
CID 2803820
N-(7-(isopropylsulfinyl)isoquinolin-3-yl)cyclopropanecarboxamide
CID 57411323
N-(7-(isopropylsulfonyl)isoquinolin-3-yl)cyclopropanecarboxamide
CID 57411324

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide (CID 3160793) is 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide is Cc1ccnc(NC(=O)CS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide?
The InChIKey is GQEKKOZDZUZQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c1-11-7-8-15-13(9-11)16-14(17)10-20(18,19)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,15,16,17).
What are the key properties of 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide?
2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide has a molecular weight of 290.34 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-N-(4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 3160793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).