N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide

C11H18N2O2S2 — CID 131924146

IUPACN-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide
SMILESCCC(NS(=O)(=O)N1CCCC1)c1cccs1
InChIInChI=1S/C11H18N2O2S2/c1-2-10(11-6-5-9-16-11)12-17(14,15)13-7-3-4-8-13/h5-6,9-10,12H,2-4,7-8H2,1H3
InChIKeyBIELFTPKBQBIFY-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.13
Rot. Bonds5

About N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide

N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide (PubChem CID 131924146) has the molecular formula C11H18N2O2S2 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide
PubChem CID131924146
Molecular FormulaC11H18N2O2S2
Molecular Weight274.41 g/mol
Exact Mass274.08
IUPAC NameN-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide
SMILESCCC(NS(=O)(=O)N1CCCC1)c1cccs1
InChIInChI=1S/C11H18N2O2S2/c1-2-10(11-6-5-9-16-11)12-17(14,15)13-7-3-4-8-13/h5-6,9-10,12H,2-4,7-8H2,1H3
InChIKeyBIELFTPKBQBIFY-UHFFFAOYSA-N
XLogP2.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-thiophen-2-ylpropyl)morpholine-4-sulfonamide
CID 47306222
4-methoxy-N-(1-thiophen-2-ylpropyl)piperidine-1-sulfonamide
CID 131905448
N-(2-phenyl-1-thiophen-2-ylethyl)pyrrolidine-1-sulfonamide
CID 176725551
3-(methylaminomethyl)-N-(1-thiophen-2-ylpropyl)piperidine-1-sulfonamide
CID 106053452
N-(1-thiophen-2-ylpropyl)ethanesulfonamide
CID 47372817
2-[1-(sulfamoylamino)propyl]thiophene
CID 112686147
1-pyrrolidin-1-yl-2-(1-thiophen-2-ylpropylamino)ethanone
CID 54964322
1-[(4-piperidin-1-ylsulfonylphenyl)methyl]-3-(1-thiophen-2-ylpropyl)urea
CID 55931237
N-(1-thiophen-2-ylethyl)morpholine-4-sulfonamide
CID 47141625
3-pyrrolidin-1-yl-N-(1-thiophen-2-ylpropyl)aniline
CID 60943707
N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]pyrrolidine-1-sulfonamide
CID 125437950
3-bromo-N-(1-thiophen-2-ylpropyl)thiophene-2-sulfonamide
CID 61068284

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide (CID 131924146) is N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide is CCC(NS(=O)(=O)N1CCCC1)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide?
The InChIKey is BIELFTPKBQBIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S2/c1-2-10(11-6-5-9-16-11)12-17(14,15)13-7-3-4-8-13/h5-6,9-10,12H,2-4,7-8H2,1H3.
What are the key properties of N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide?
N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide has a molecular weight of 274.41 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 131924146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).