N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide

C16H24N4O3S — CID 75256994

IUPACN-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
SMILESCCC1NNC(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)C1C
InChIInChI=1S/C16H24N4O3S/c1-3-14-11(2)16(18-17-14)19-24(22,23)13-8-6-12(7-9-13)20-10-4-5-15(20)21/h6-9,11,14,16-19H,3-5,10H2,1-2H3
InChIKeyFWQUFCZPFFOJMR-UHFFFAOYSA-N
MW352.46 g/mol
LogP0.94
Rot. Bonds5

About N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide

N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide (PubChem CID 75256994) has the molecular formula C16H24N4O3S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
PubChem CID75256994
Molecular FormulaC16H24N4O3S
Molecular Weight352.46 g/mol
Exact Mass352.16
IUPAC NameN-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
SMILESCCC1NNC(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)C1C
InChIInChI=1S/C16H24N4O3S/c1-3-14-11(2)16(18-17-14)19-24(22,23)13-8-6-12(7-9-13)20-10-4-5-15(20)21/h6-9,11,14,16-19H,3-5,10H2,1-2H3
InChIKeyFWQUFCZPFFOJMR-UHFFFAOYSA-N
XLogP0.94
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 22695508
N-cyclooctyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 18096700
N-[(1R,6R)-7-bicyclo[4.1.0]heptanyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 98137665
4-(2-oxopyrrolidin-1-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 8823939
N-[(2R)-butan-2-yl]-4-(2-oxopiperidin-1-yl)benzenesulfonamide
CID 42346693
N-(dicyclopropylmethyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 31847318
4-(2-oxopyrrolidin-1-yl)-N-pentan-2-ylbenzenesulfonamide
CID 43886220
N-[3-(2-ethylpiperidin-1-yl)propyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 46778535
N-(4-methylsulfonylphenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 8823223
N-[(2R)-3-methylbutan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 41200777
N-[6-(ethylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 68914747
N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 94019456

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide (CID 75256994) is N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide is CCC1NNC(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)C1C.
What is the InChIKey of N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The InChIKey is FWQUFCZPFFOJMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3S/c1-3-14-11(2)16(18-17-14)19-24(22,23)13-8-6-12(7-9-13)20-10-4-5-15(20)21/h6-9,11,14,16-19H,3-5,10H2,1-2H3.
What are the key properties of N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide has a molecular weight of 352.46 g/mol, XLogP of 0.94, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-4-methylpyrazolidin-3-yl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 75256994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).