2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

C19H27N5O6S — CID 27532874

IUPAC2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NN2C(=O)NC3(CCCCC3)C2=O)c1
InChIInChI=1S/C19H27N5O6S/c1-3-23(4-2)31(29,30)14-8-9-16(26)22(12-14)13-15(25)21-24-17(27)19(20-18(24)28)10-6-5-7-11-19/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,20,28)(H,21,25)
InChIKeyURGGWBKNKJIXAD-UHFFFAOYSA-N
MW453.52 g/mol
LogP0.16
Rot. Bonds7

About 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide (PubChem CID 27532874) has the molecular formula C19H27N5O6S and a molecular weight of 453.52 g/mol. Its IUPAC name is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide.

Molecular Properties

Compound Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
PubChem CID27532874
Molecular FormulaC19H27N5O6S
Molecular Weight453.52 g/mol
Exact Mass453.17
IUPAC Name2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NN2C(=O)NC3(CCCCC3)C2=O)c1
InChIInChI=1S/C19H27N5O6S/c1-3-23(4-2)31(29,30)14-8-9-16(26)22(12-14)13-15(25)21-24-17(27)19(20-18(24)28)10-6-5-7-11-19/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,20,28)(H,21,25)
InChIKeyURGGWBKNKJIXAD-UHFFFAOYSA-N
XLogP0.16
TPSA137.89 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.52
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

[2-[(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)amino]-2-oxoethyl] 3-(diethylsulfamoyl)benzoate
CID 16521313
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-(2,4,5-trichlorophenyl)acetamide
CID 41114327
N-(3-cyclopentylpropyl)-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 30806622
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 43005232
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]acetamide
CID 42490480
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 51215892
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(4-iodophenyl)acetamide
CID 16552124
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 30765589
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 47035955
N-[(3-chlorophenyl)methyl]-2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]acetamide
CID 9401741

Frequently Asked Questions

What is the IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
The IUPAC name of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide (CID 27532874) is 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide.
What is the SMILES notation for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
The canonical SMILES for 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide is CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NN2C(=O)NC3(CCCCC3)C2=O)c1.
What is the InChIKey of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
The InChIKey is URGGWBKNKJIXAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O6S/c1-3-23(4-2)31(29,30)14-8-9-16(26)22(12-14)13-15(25)21-24-17(27)19(20-18(24)28)10-6-5-7-11-19/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,20,28)(H,21,25).
What are the key properties of 2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide has a molecular weight of 453.52 g/mol, XLogP of 0.16, 7 rotatable bonds, 2 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-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide is sourced from PubChem (CID 27532874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).