2-(cyclohexen-1-yl)ethanesulfonamide

C8H15NO2S — CID 130905515

IUPAC2-(cyclohexen-1-yl)ethanesulfonamide
SMILESNS(=O)(=O)CCC1=CCCCC1
InChIInChI=1S/C8H15NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h4H,1-3,5-7H2,(H2,9,10,11)
InChIKeyKLQLKKHDTHSDBA-UHFFFAOYSA-N
MW189.28 g/mol
LogP1.17
Rot. Bonds3

About 2-(cyclohexen-1-yl)ethanesulfonamide

2-(cyclohexen-1-yl)ethanesulfonamide (PubChem CID 130905515) has the molecular formula C8H15NO2S and a molecular weight of 189.28 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)ethanesulfonamide.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)ethanesulfonamide
PubChem CID130905515
Molecular FormulaC8H15NO2S
Molecular Weight189.28 g/mol
Exact Mass189.08
IUPAC Name2-(cyclohexen-1-yl)ethanesulfonamide
SMILESNS(=O)(=O)CCC1=CCCCC1
InChIInChI=1S/C8H15NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h4H,1-3,5-7H2,(H2,9,10,11)
InChIKeyKLQLKKHDTHSDBA-UHFFFAOYSA-N
XLogP1.17
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 13222764
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CID 21889789
CID 21889789
CID 97005175
CID 97005175
CID 114763869
CID 114763869
CID 139661004
CID 139661004
CID 146175197
CID 146175197
CID 149422579
CID 149422579
CID 150179819
CID 150179819
CID 153696913
CID 153696913

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)ethanesulfonamide?
The IUPAC name of 2-(cyclohexen-1-yl)ethanesulfonamide (CID 130905515) is 2-(cyclohexen-1-yl)ethanesulfonamide.
What is the SMILES notation for 2-(cyclohexen-1-yl)ethanesulfonamide?
The canonical SMILES for 2-(cyclohexen-1-yl)ethanesulfonamide is NS(=O)(=O)CCC1=CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)ethanesulfonamide?
The InChIKey is KLQLKKHDTHSDBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h4H,1-3,5-7H2,(H2,9,10,11).
What are the key properties of 2-(cyclohexen-1-yl)ethanesulfonamide?
2-(cyclohexen-1-yl)ethanesulfonamide has a molecular weight of 189.28 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)ethanesulfonamide is sourced from PubChem (CID 130905515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).