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

C13H21N3O4S — CID 7828897

IUPAC2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)Cn1cc(S(=O)(=O)N(C)C)ccc1=O
InChIInChI=1S/C13H21N3O4S/c1-5-15(6-2)13(18)10-16-9-11(7-8-12(16)17)21(19,20)14(3)4/h7-9H,5-6,10H2,1-4H3
InChIKeyDAKSBSYTZNLLOW-UHFFFAOYSA-N
MW315.40 g/mol
LogP-0.03
Rot. Bonds6

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

2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide (PubChem CID 7828897) has the molecular formula C13H21N3O4S and a molecular weight of 315.40 g/mol. Its IUPAC name is 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide
PubChem CID7828897
Molecular FormulaC13H21N3O4S
Molecular Weight315.40 g/mol
Exact Mass315.13
IUPAC Name2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)Cn1cc(S(=O)(=O)N(C)C)ccc1=O
InChIInChI=1S/C13H21N3O4S/c1-5-15(6-2)13(18)10-16-9-11(7-8-12(16)17)21(19,20)14(3)4/h7-9H,5-6,10H2,1-4H3
InChIKeyDAKSBSYTZNLLOW-UHFFFAOYSA-N
XLogP-0.03
TPSA79.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 5-0.03
H-Bond Donors ≤ 50
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,N-diethylacetamide?
The IUPAC name of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide (CID 7828897) is 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide.
What is the SMILES notation for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide?
The canonical SMILES for 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide is CCN(CC)C(=O)Cn1cc(S(=O)(=O)N(C)C)ccc1=O.
What is the InChIKey of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide?
The InChIKey is DAKSBSYTZNLLOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O4S/c1-5-15(6-2)13(18)10-16-9-11(7-8-12(16)17)21(19,20)14(3)4/h7-9H,5-6,10H2,1-4H3.
What are the key properties of 2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide?
2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N,N-diethylacetamide has a molecular weight of 315.40 g/mol, XLogP of -0.03, 6 rotatable bonds, 0 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,N-diethylacetamide is sourced from PubChem (CID 7828897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).