2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide

C23H32N4O4S — CID 43005232

IUPAC2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NCC(c2ccccc2)N2CCCC2)c1
InChIInChI=1S/C23H32N4O4S/c1-3-27(4-2)32(30,31)20-12-13-23(29)26(17-20)18-22(28)24-16-21(25-14-8-9-15-25)19-10-6-5-7-11-19/h5-7,10-13,17,21H,3-4,8-9,14-16,18H2,1-2H3,(H,24,28)
InChIKeyDQXCTIRLAFYABO-UHFFFAOYSA-N
MW460.60 g/mol
LogP1.83
Rot. Bonds10

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 43005232) has the molecular formula C23H32N4O4S and a molecular weight of 460.60 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide
PubChem CID43005232
Molecular FormulaC23H32N4O4S
Molecular Weight460.60 g/mol
Exact Mass460.21
IUPAC Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NCC(c2ccccc2)N2CCCC2)c1
InChIInChI=1S/C23H32N4O4S/c1-3-27(4-2)32(30,31)20-12-13-23(29)26(17-20)18-22(28)24-16-21(25-14-8-9-15-25)19-10-6-5-7-11-19/h5-7,10-13,17,21H,3-4,8-9,14-16,18H2,1-2H3,(H,24,28)
InChIKeyDQXCTIRLAFYABO-UHFFFAOYSA-N
XLogP1.83
TPSA91.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.60
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide
CID 26809065
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[furan-2-yl(phenyl)methyl]acetamide
CID 55384576
N,N-diethyl-4-[2-[(2-phenyl-2-pyrrolidin-1-ylethyl)amino]acetyl]benzenesulfonamide
CID 110827935
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-prop-2-enylacetamide
CID 9399528
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide
CID 47035882
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 30765589
N-(3-cyclopentylpropyl)-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 30806622
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 27532874
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(4-iodophenyl)acetamide
CID 16552124
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 7768251
N,N-diethyl-6-oxo-1-[2-oxo-2-[(2S)-2-phenylpyrrolidin-1-yl]ethyl]pyridine-3-sulfonamide
CID 30218825
N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ylethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 126448414

Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide (CID 43005232) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NCC(c2ccccc2)N2CCCC2)c1.
What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is DQXCTIRLAFYABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O4S/c1-3-27(4-2)32(30,31)20-12-13-23(29)26(17-20)18-22(28)24-16-21(25-14-8-9-15-25)19-10-6-5-7-11-19/h5-7,10-13,17,21H,3-4,8-9,14-16,18H2,1-2H3,(H,24,28).
What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide?
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 460.60 g/mol, XLogP of 1.83, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 43005232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).