2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide

C11H20N2O3S — CID 56749205

IUPAC2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide
SMILESCN(C)S(=O)(=O)CCNC(=O)CC1C=CCC1
InChIInChI=1S/C11H20N2O3S/c1-13(2)17(15,16)8-7-12-11(14)9-10-5-3-4-6-10/h3,5,10H,4,6-9H2,1-2H3,(H,12,14)
InChIKeyAGWHOQNSUGRQIX-UHFFFAOYSA-N
MW260.36 g/mol
LogP0.35
Rot. Bonds6

About 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide

2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide (PubChem CID 56749205) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide
PubChem CID56749205
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC Name2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide
SMILESCN(C)S(=O)(=O)CCNC(=O)CC1C=CCC1
InChIInChI=1S/C11H20N2O3S/c1-13(2)17(15,16)8-7-12-11(14)9-10-5-3-4-6-10/h3,5,10H,4,6-9H2,1-2H3,(H,12,14)
InChIKeyAGWHOQNSUGRQIX-UHFFFAOYSA-N
XLogP0.35
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-methylsulfonylpiperidin-4-yl)cyclohex-3-ene-1-carboxamide
CID 42949879
N-(1,1-dioxothiolan-3-yl)cyclohex-3-ene-1-carboxamide
CID 45797858
N-((1-(methylsulfonyl)piperidin-4-yl)methyl)cyclohex-3-enecarboxamide
CID 71796763
N-{[1-(cyclopropanesulfonyl)piperidin-4-yl]methyl}cyclohex-3-ene-1-carboxamide
CID 71796803
(1R,6R)-6-methyl-N-[(2S,3S)-2-methyl-1,1-dioxothiolan-3-yl]cyclohex-3-ene-1-carboxamide
CID 128534373
2-cyclopent-2-en-1-yl-N-(1-methylsulfonylpiperidin-4-yl)acetamide
CID 42949878
2-cyclopent-2-en-1-yl-N-[3-[methyl(methylsulfonyl)amino]propyl]acetamide
CID 45884763
2-cyclopent-2-en-1-yl-N-methyl-N-propan-2-ylsulfonylacetamide
CID 71859617
N-(2-methylsulfonylsulfanylethyl)-7-[(1R,2S)-2-pent-1-enylcyclopentyl]hept-5-enamide
CID 68722298
N-[(1E)-1-(2-methylcyclopentylidene)pentan-3-yl]-5-(propan-2-ylsulfinylamino)pentanamide
CID 70892579
sodium 2-[[(Z)-2-methyloctadec-9-enoyl]amino]ethanesulfonate
CID 87788287
5-(propan-2-ylsulfinylamino)-N-[(Z,3S)-3-prop-2-enyl-6-sulfamoylhex-4-enyl]pentanamide
CID 89215100

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide (CID 56749205) is 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide is CN(C)S(=O)(=O)CCNC(=O)CC1C=CCC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide?
The InChIKey is AGWHOQNSUGRQIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S/c1-13(2)17(15,16)8-7-12-11(14)9-10-5-3-4-6-10/h3,5,10H,4,6-9H2,1-2H3,(H,12,14).
What are the key properties of 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide?
2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide has a molecular weight of 260.36 g/mol, XLogP of 0.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-[2-(dimethylsulfamoyl)ethyl]acetamide is sourced from PubChem (CID 56749205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).