2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide

C12H19N3O4S — CID 7828914

IUPAC2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide
SMILESCCCNC(=O)Cn1cc(S(=O)(=O)N(C)C)ccc1=O
InChIInChI=1S/C12H19N3O4S/c1-4-7-13-11(16)9-15-8-10(5-6-12(15)17)20(18,19)14(2)3/h5-6,8H,4,7,9H2,1-3H3,(H,13,16)
InChIKeyHPPYVJOYJRJQJA-UHFFFAOYSA-N
MW301.37 g/mol
LogP-0.38
Rot. Bonds6

About 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide

2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide (PubChem CID 7828914) has the molecular formula C12H19N3O4S and a molecular weight of 301.37 g/mol. Its IUPAC name is 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide.

Molecular Properties

Compound Name2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide
PubChem CID7828914
Molecular FormulaC12H19N3O4S
Molecular Weight301.37 g/mol
Exact Mass301.11
IUPAC Name2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide
SMILESCCCNC(=O)Cn1cc(S(=O)(=O)N(C)C)ccc1=O
InChIInChI=1S/C12H19N3O4S/c1-4-7-13-11(16)9-15-8-10(5-6-12(15)17)20(18,19)14(2)3/h5-6,8H,4,7,9H2,1-3H3,(H,13,16)
InChIKeyHPPYVJOYJRJQJA-UHFFFAOYSA-N
XLogP-0.38
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide?
The IUPAC name of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide (CID 7828914) is 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide.
What is the SMILES notation for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide?
The canonical SMILES for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide is CCCNC(=O)Cn1cc(S(=O)(=O)N(C)C)ccc1=O.
What is the InChIKey of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide?
The InChIKey is HPPYVJOYJRJQJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O4S/c1-4-7-13-11(16)9-15-8-10(5-6-12(15)17)20(18,19)14(2)3/h5-6,8H,4,7,9H2,1-3H3,(H,13,16).
What are the key properties of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide?
2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide has a molecular weight of 301.37 g/mol, XLogP of -0.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-propylacetamide is sourced from PubChem (CID 7828914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).