N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide

C13H21N3O4S — CID 7828898

IUPACN-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NC(C)(C)C)c1
InChIInChI=1S/C13H21N3O4S/c1-13(2,3)14-11(17)9-16-8-10(6-7-12(16)18)21(19,20)15(4)5/h6-8H,9H2,1-5H3,(H,14,17)
InChIKeyDMFRVMPAVIBZCE-UHFFFAOYSA-N
MW315.40 g/mol
LogP0.01
Rot. Bonds4

About N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide

N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide (PubChem CID 7828898) has the molecular formula C13H21N3O4S and a molecular weight of 315.40 g/mol. Its IUPAC name is N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
PubChem CID7828898
Molecular FormulaC13H21N3O4S
Molecular Weight315.40 g/mol
Exact Mass315.13
IUPAC NameN-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NC(C)(C)C)c1
InChIInChI=1S/C13H21N3O4S/c1-13(2,3)14-11(17)9-16-8-10(6-7-12(16)18)21(19,20)15(4)5/h6-8H,9H2,1-5H3,(H,14,17)
InChIKeyDMFRVMPAVIBZCE-UHFFFAOYSA-N
XLogP0.01
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(tert-butyl)-2-(3-((4-methylpiperidin-1-yl)sulfonyl)-2-oxopyridin-1(2H)-yl)acetamide
CID 49666402
N-(1,1-dimethylpropyl)-2-[3-[(ethylsulfonyl)amino]-6-methyl-2-oxopyridin-1(2H)-yl]acetamide
CID 53161413
N-(tert-butyl)-2-(2-oxo-3-(pyrrolidin-1-ylsulfonyl)pyridin-1(2H)-yl)acetamide
CID 49666324
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,2,2-trifluoroethyl)acetamide
CID 7768185
2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,2,2-trifluoroethyl)acetamide
CID 7828880
2-[methyl-[(6-oxo-1H-pyridin-3-yl)sulfonyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 60959362
2-(2-oxo-5-(piperidin-1-ylsulfonyl)pyridin-1(2H)-yl)-N-propylacetamide
CID 49667032
N-tert-butyl-2-oxo-1-propylpyridine-3-sulfonamide
CID 53723533
2-(3-amino-2-oxo-1-pyridinyl)-N-methylsulfonylacetamide
CID 135186696
2-(3-amino-2-oxo-1-pyridinyl)-N-ethylsulfonylacetamide
CID 135186820
1-[2-(Dimethylamino)ethyl]-1,6-dihydro-6-oxo-3-pyridinesulfonamide
CID 137403789
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-methoxyethyl)acetamide
CID 7252293

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide (CID 7828898) is N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide is CN(C)S(=O)(=O)c1ccc(=O)n(CC(=O)NC(C)(C)C)c1.
What is the InChIKey of N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide?
The InChIKey is DMFRVMPAVIBZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O4S/c1-13(2,3)14-11(17)9-16-8-10(6-7-12(16)18)21(19,20)15(4)5/h6-8H,9H2,1-5H3,(H,14,17).
What are the key properties of N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide?
N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide has a molecular weight of 315.40 g/mol, XLogP of 0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 7828898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).