N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide

C13H16N2O3S — CID 22695508

IUPACN-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
SMILESO=C1CCCN1c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C13H16N2O3S/c16-13-2-1-9-15(13)11-5-7-12(8-6-11)19(17,18)14-10-3-4-10/h5-8,10,14H,1-4,9H2
InChIKeyJUJCWPLZGQJMNW-UHFFFAOYSA-N
MW280.35 g/mol
LogP1.25
Rot. Bonds4

About N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide

N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide (PubChem CID 22695508) has the molecular formula C13H16N2O3S and a molecular weight of 280.35 g/mol. Its IUPAC name is N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
PubChem CID22695508
Molecular FormulaC13H16N2O3S
Molecular Weight280.35 g/mol
Exact Mass280.09
IUPAC NameN-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
SMILESO=C1CCCN1c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C13H16N2O3S/c16-13-2-1-9-15(13)11-5-7-12(8-6-11)19(17,18)14-10-3-4-10/h5-8,10,14H,1-4,9H2
InChIKeyJUJCWPLZGQJMNW-UHFFFAOYSA-N
XLogP1.25
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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-(dicyclopropylmethyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 31847318
N-cyclopentyloxy-4-(2-oxopiperidin-1-yl)benzenesulfonamide
CID 110666979
N-cyclopentyl-2-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 47081376
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
N-cyclododecyl-4-(2,5-dioxopyrrolidin-1-yl)benzenesulfonamide
CID 146022850
N-cyclohexyl-4-(2,5-dioxopyrrolidin-1-yl)benzenesulfonamide
CID 22695550
N-(4-methylsulfonylphenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 8823223
N-(4-chlorophenyl)-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 8822397
N-cyclotridecyl-4-(3-hydroxy-2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 146711957

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide (CID 22695508) is N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide is O=C1CCCN1c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
The InChIKey is JUJCWPLZGQJMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3S/c16-13-2-1-9-15(13)11-5-7-12(8-6-11)19(17,18)14-10-3-4-10/h5-8,10,14H,1-4,9H2.
What are the key properties of N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide?
N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide has a molecular weight of 280.35 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 22695508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).