2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide

C18H24N2O3S — CID 51127332

IUPAC2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide
SMILESCCCn1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)ccc1=O
InChIInChI=1S/C18H24N2O3S/c1-6-9-20-11-16(7-8-17(20)21)19-24(22,23)18-14(4)12(2)10-13(3)15(18)5/h7-8,10-11,19H,6,9H2,1-5H3
InChIKeyZOWVOLNDFCDGPB-UHFFFAOYSA-N
MW348.47 g/mol
LogP3.29
Rot. Bonds5

About 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide

2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide (PubChem CID 51127332) has the molecular formula C18H24N2O3S and a molecular weight of 348.47 g/mol. Its IUPAC name is 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide
PubChem CID51127332
Molecular FormulaC18H24N2O3S
Molecular Weight348.47 g/mol
Exact Mass348.15
IUPAC Name2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide
SMILESCCCn1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)ccc1=O
InChIInChI=1S/C18H24N2O3S/c1-6-9-20-11-16(7-8-17(20)21)19-24(22,23)18-14(4)12(2)10-13(3)15(18)5/h7-8,10-11,19H,6,9H2,1-5H3
InChIKeyZOWVOLNDFCDGPB-UHFFFAOYSA-N
XLogP3.29
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(6-oxo-1-propyl-3-pyridinyl)pyrimidine-5-sulfonamide
CID 61041715
2-chloro-N-(6-oxo-1-propyl-3-pyridinyl)ethanesulfonamide
CID 107651563
3-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 105358658
5-chloro-N-[1-(2-hydroxyethyl)-6-oxo-3-pyridinyl]-4-methylthiophene-2-sulfonamide
CID 126828839
2,3,5,6-tetramethyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 22772989
methyl 4-[(6-oxo-1-propyl-3-pyridinyl)sulfamoyl]butanoate
CID 61460257
5-[(2-methylphenyl)methylamino]-1-propylpyridin-2-one
CID 54863932
1-propyl-5-(prop-2-ynylamino)pyridin-2-one
CID 63951085
2,3,5,6-tetramethyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide
CID 20933603
5-[1-(2,4-dimethylphenyl)ethylamino]-1-propylpyridin-2-one
CID 60943688
2-amino-6-methyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 61125702
2-amino-3,6-dimethyl-N-(1-methyl-6-oxo-3-pyridinyl)benzenesulfonamide
CID 103171310

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide (CID 51127332) is 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide is CCCn1cc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)ccc1=O.
What is the InChIKey of 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide?
The InChIKey is ZOWVOLNDFCDGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3S/c1-6-9-20-11-16(7-8-17(20)21)19-24(22,23)18-14(4)12(2)10-13(3)15(18)5/h7-8,10-11,19H,6,9H2,1-5H3.
What are the key properties of 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide?
2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide has a molecular weight of 348.47 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetramethyl-N-(6-oxo-1-propyl-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 51127332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).