N-cyclopent-3-en-1-ylmethanesulfonamide;ethane

C8H17NO2S — CID 167493523

IUPACN-cyclopent-3-en-1-ylmethanesulfonamide;ethane
SMILESCC.CS(=O)(=O)NC1CC=CC1
InChIInChI=1S/C6H11NO2S.C2H6/c1-10(8,9)7-6-4-2-3-5-6;1-2/h2-3,6-7H,4-5H2,1H3;1-2H3
InChIKeyVISZZJJPCAADJV-UHFFFAOYSA-N
MW191.30 g/mol
LogP1.28
Rot. Bonds2

About N-cyclopent-3-en-1-ylmethanesulfonamide;ethane

N-cyclopent-3-en-1-ylmethanesulfonamide;ethane (PubChem CID 167493523) has the molecular formula C8H17NO2S and a molecular weight of 191.30 g/mol. Its IUPAC name is N-cyclopent-3-en-1-ylmethanesulfonamide;ethane.

Molecular Properties

Compound NameN-cyclopent-3-en-1-ylmethanesulfonamide;ethane
PubChem CID167493523
Molecular FormulaC8H17NO2S
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC NameN-cyclopent-3-en-1-ylmethanesulfonamide;ethane
SMILESCC.CS(=O)(=O)NC1CC=CC1
InChIInChI=1S/C6H11NO2S.C2H6/c1-10(8,9)7-6-4-2-3-5-6;1-2/h2-3,6-7H,4-5H2,1H3;1-2H3
InChIKeyVISZZJJPCAADJV-UHFFFAOYSA-N
XLogP1.28
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopent-3-en-1-ylmethanesulfonamide;ethane?
The IUPAC name of N-cyclopent-3-en-1-ylmethanesulfonamide;ethane (CID 167493523) is N-cyclopent-3-en-1-ylmethanesulfonamide;ethane.
What is the SMILES notation for N-cyclopent-3-en-1-ylmethanesulfonamide;ethane?
The canonical SMILES for N-cyclopent-3-en-1-ylmethanesulfonamide;ethane is CC.CS(=O)(=O)NC1CC=CC1.
What is the InChIKey of N-cyclopent-3-en-1-ylmethanesulfonamide;ethane?
The InChIKey is VISZZJJPCAADJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2S.C2H6/c1-10(8,9)7-6-4-2-3-5-6;1-2/h2-3,6-7H,4-5H2,1H3;1-2H3.
What are the key properties of N-cyclopent-3-en-1-ylmethanesulfonamide;ethane?
N-cyclopent-3-en-1-ylmethanesulfonamide;ethane has a molecular weight of 191.30 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopent-3-en-1-ylmethanesulfonamide;ethane is sourced from PubChem (CID 167493523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).