2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide

C22H38N4O5S — CID 46539458

IUPAC2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide
SMILESCCC(CC)C(CNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O)N1CCOCC1
InChIInChI=1S/C22H38N4O5S/c1-5-18(6-2)20(24-11-13-31-14-12-24)15-23-21(27)17-25-16-19(9-10-22(25)28)32(29,30)26(7-3)8-4/h9-10,16,18,20H,5-8,11-15,17H2,1-4H3,(H,23,27)
InChIKeySKKHTCXDEBOYAL-UHFFFAOYSA-N
MW470.64 g/mol
LogP1.13
Rot. Bonds12

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide (PubChem CID 46539458) has the molecular formula C22H38N4O5S and a molecular weight of 470.64 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide.

Molecular Properties

Compound Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide
PubChem CID46539458
Molecular FormulaC22H38N4O5S
Molecular Weight470.64 g/mol
Exact Mass470.26
IUPAC Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide
SMILESCCC(CC)C(CNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O)N1CCOCC1
InChIInChI=1S/C22H38N4O5S/c1-5-18(6-2)20(24-11-13-31-14-12-24)15-23-21(27)17-25-16-19(9-10-22(25)28)32(29,30)26(7-3)8-4/h9-10,16,18,20H,5-8,11-15,17H2,1-4H3,(H,23,27)
InChIKeySKKHTCXDEBOYAL-UHFFFAOYSA-N
XLogP1.13
TPSA100.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds12
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.64
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide?
The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide (CID 46539458) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide.
What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide?
The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide is CCC(CC)C(CNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O)N1CCOCC1.
What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide?
The InChIKey is SKKHTCXDEBOYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38N4O5S/c1-5-18(6-2)20(24-11-13-31-14-12-24)15-23-21(27)17-25-16-19(9-10-22(25)28)32(29,30)26(7-3)8-4/h9-10,16,18,20H,5-8,11-15,17H2,1-4H3,(H,23,27).
What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide?
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide has a molecular weight of 470.64 g/mol, XLogP of 1.13, 12 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide is sourced from PubChem (CID 46539458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).