N-propylsulfonyl-2-pyrrolidin-2-ylacetamide

C9H18N2O3S — CID 103307605

IUPACN-propylsulfonyl-2-pyrrolidin-2-ylacetamide
SMILESCCCS(=O)(=O)NC(=O)CC1CCCN1
InChIInChI=1S/C9H18N2O3S/c1-2-6-15(13,14)11-9(12)7-8-4-3-5-10-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeyUPIFSVGKDMGOAU-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.02
Rot. Bonds5

About N-propylsulfonyl-2-pyrrolidin-2-ylacetamide

N-propylsulfonyl-2-pyrrolidin-2-ylacetamide (PubChem CID 103307605) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is N-propylsulfonyl-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-propylsulfonyl-2-pyrrolidin-2-ylacetamide
PubChem CID103307605
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC NameN-propylsulfonyl-2-pyrrolidin-2-ylacetamide
SMILESCCCS(=O)(=O)NC(=O)CC1CCCN1
InChIInChI=1S/C9H18N2O3S/c1-2-6-15(13,14)11-9(12)7-8-4-3-5-10-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeyUPIFSVGKDMGOAU-UHFFFAOYSA-N
XLogP-0.02
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[(2S)-pyrrolidin-2-yl]acetamide
CID 66778094
N-methyl-2-[(2R)-pyrrolidin-2-yl]acetamide
CID 66776546
N-[1-(2-pyrrolidin-2-ylacetyl)piperidin-4-yl]propane-1-sulfonamide
CID 119732751
N-(1-ethylsulfonylpropan-2-yl)-2-pyrrolidin-2-ylacetamide
CID 119786793
N-[2-(propan-2-ylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119758912
N-(1-ethylsulfonylpiperidin-4-yl)-2-pyrrolidin-2-ylacetamide
CID 61365867
N-[1-(2-pyrrolidin-2-ylacetyl)piperidin-4-yl]propane-1-sulfonamide;hydrochloride
CID 119732750
2-propylsulfonyl-N-(pyrrolidin-2-ylmethyl)acetamide;hydrochloride
CID 119510423
N-[4-(butylsulfonylamino)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119800516
2-pyrrolidin-2-yl-N-(2-sulfamoylethyl)acetamide
CID 61371209
N-octyl-2-pyrrolidin-2-ylacetamide
CID 115567860
N-(2-methylpentan-2-yl)-2-pyrrolidin-2-ylacetamide
CID 115738895

Frequently Asked Questions

What is the IUPAC name of N-propylsulfonyl-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-propylsulfonyl-2-pyrrolidin-2-ylacetamide (CID 103307605) is N-propylsulfonyl-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-propylsulfonyl-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-propylsulfonyl-2-pyrrolidin-2-ylacetamide is CCCS(=O)(=O)NC(=O)CC1CCCN1.
What is the InChIKey of N-propylsulfonyl-2-pyrrolidin-2-ylacetamide?
The InChIKey is UPIFSVGKDMGOAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c1-2-6-15(13,14)11-9(12)7-8-4-3-5-10-8/h8,10H,2-7H2,1H3,(H,11,12).
What are the key properties of N-propylsulfonyl-2-pyrrolidin-2-ylacetamide?
N-propylsulfonyl-2-pyrrolidin-2-ylacetamide has a molecular weight of 234.32 g/mol, XLogP of -0.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylsulfonyl-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 103307605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).