2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide

C20H24N6O4S — CID 30873268

IUPAC2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)Nc2ccc(Cn3cncn3)cc2)c1
InChIInChI=1S/C20H24N6O4S/c1-3-26(4-2)31(29,30)18-9-10-20(28)24(12-18)13-19(27)23-17-7-5-16(6-8-17)11-25-15-21-14-22-25/h5-10,12,14-15H,3-4,11,13H2,1-2H3,(H,23,27)
InChIKeyFNMOUPLSDVMASS-UHFFFAOYSA-N
MW444.52 g/mol
LogP1.16
Rot. Bonds9

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide (PubChem CID 30873268) has the molecular formula C20H24N6O4S and a molecular weight of 444.52 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide
PubChem CID30873268
Molecular FormulaC20H24N6O4S
Molecular Weight444.52 g/mol
Exact Mass444.16
IUPAC Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)Nc2ccc(Cn3cncn3)cc2)c1
InChIInChI=1S/C20H24N6O4S/c1-3-26(4-2)31(29,30)18-9-10-20(28)24(12-18)13-19(27)23-17-7-5-16(6-8-17)11-25-15-21-14-22-25/h5-10,12,14-15H,3-4,11,13H2,1-2H3,(H,23,27)
InChIKeyFNMOUPLSDVMASS-UHFFFAOYSA-N
XLogP1.16
TPSA119.19 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.52
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide with MolForge

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Related Compounds

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(4-iodophenyl)acetamide
CID 16552124
N-(4-cyanophenyl)-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 16552503
N-[4-[(2S)-butan-2-yl]phenyl]-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 7768257
methyl 1-[2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl]-6-oxopyridine-3-carboxylate
CID 24609497
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 55484749
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-fluorophenyl)acetamide
CID 7252285
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4,5-trichlorophenyl)acetamide
CID 41114327
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]acetamide
CID 42490480
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(4-ethyl-3-nitrophenyl)acetamide
CID 30839874
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(4-methyl-3-nitrophenyl)acetamide
CID 26719575
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]acetamide
CID 46467139
N-(5-chloro-2-fluorophenyl)-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 7252282

Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide?
The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide (CID 30873268) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide.
What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide?
The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)Nc2ccc(Cn3cncn3)cc2)c1.
What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide?
The InChIKey is FNMOUPLSDVMASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O4S/c1-3-26(4-2)31(29,30)18-9-10-20(28)24(12-18)13-19(27)23-17-7-5-16(6-8-17)11-25-15-21-14-22-25/h5-10,12,14-15H,3-4,11,13H2,1-2H3,(H,23,27).
What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide?
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide has a molecular weight of 444.52 g/mol, XLogP of 1.16, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]acetamide is sourced from PubChem (CID 30873268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).