2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide

C16H27N3O4S — CID 7252296

IUPAC2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O
InChIInChI=1S/C16H27N3O4S/c1-5-13(6-2)17-15(20)12-18-11-14(9-10-16(18)21)24(22,23)19(7-3)8-4/h9-11,13H,5-8,12H2,1-4H3,(H,17,20)
InChIKeyQXMLVSMPQKIOTF-UHFFFAOYSA-N
MW357.48 g/mol
LogP1.18
Rot. Bonds9

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide (PubChem CID 7252296) has the molecular formula C16H27N3O4S and a molecular weight of 357.48 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide.

Molecular Properties

Compound Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide
PubChem CID7252296
Molecular FormulaC16H27N3O4S
Molecular Weight357.48 g/mol
Exact Mass357.17
IUPAC Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O
InChIInChI=1S/C16H27N3O4S/c1-5-13(6-2)17-15(20)12-18-11-14(9-10-16(18)21)24(22,23)19(7-3)8-4/h9-11,13H,5-8,12H2,1-4H3,(H,17,20)
InChIKeyQXMLVSMPQKIOTF-UHFFFAOYSA-N
XLogP1.18
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide?
The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide (CID 7252296) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide.
What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide?
The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide is CCC(CC)NC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O.
What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide?
The InChIKey is QXMLVSMPQKIOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O4S/c1-5-13(6-2)17-15(20)12-18-11-14(9-10-16(18)21)24(22,23)19(7-3)8-4/h9-11,13H,5-8,12H2,1-4H3,(H,17,20).
What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide?
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide has a molecular weight of 357.48 g/mol, XLogP of 1.18, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-pentan-3-ylacetamide is sourced from PubChem (CID 7252296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).