5-pent-4-enylsulfonylpent-1-ene

C10H18O2S — CID 11506665

IUPAC5-pent-4-enylsulfonylpent-1-ene
SMILESC=CCCCS(=O)(=O)CCCC=C
InChIInChI=1S/C10H18O2S/c1-3-5-7-9-13(11,12)10-8-6-4-2/h3-4H,1-2,5-10H2
InChIKeySEHLHBNURCGOPR-UHFFFAOYSA-N
MW202.32 g/mol
LogP2.33
Rot. Bonds8

About 5-pent-4-enylsulfonylpent-1-ene

5-pent-4-enylsulfonylpent-1-ene (PubChem CID 11506665) has the molecular formula C10H18O2S and a molecular weight of 202.32 g/mol. Its IUPAC name is 5-pent-4-enylsulfonylpent-1-ene.

Molecular Properties

Compound Name5-pent-4-enylsulfonylpent-1-ene
PubChem CID11506665
Molecular FormulaC10H18O2S
Molecular Weight202.32 g/mol
Exact Mass202.10
IUPAC Name5-pent-4-enylsulfonylpent-1-ene
SMILESC=CCCCS(=O)(=O)CCCC=C
InChIInChI=1S/C10H18O2S/c1-3-5-7-9-13(11,12)10-8-6-4-2/h3-4H,1-2,5-10H2
InChIKeySEHLHBNURCGOPR-UHFFFAOYSA-N
XLogP2.33
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-pent-4-enylsulfonylpent-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-pent-4-enylsulfonylpent-1-ene?
The IUPAC name of 5-pent-4-enylsulfonylpent-1-ene (CID 11506665) is 5-pent-4-enylsulfonylpent-1-ene.
What is the SMILES notation for 5-pent-4-enylsulfonylpent-1-ene?
The canonical SMILES for 5-pent-4-enylsulfonylpent-1-ene is C=CCCCS(=O)(=O)CCCC=C.
What is the InChIKey of 5-pent-4-enylsulfonylpent-1-ene?
The InChIKey is SEHLHBNURCGOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2S/c1-3-5-7-9-13(11,12)10-8-6-4-2/h3-4H,1-2,5-10H2.
What are the key properties of 5-pent-4-enylsulfonylpent-1-ene?
5-pent-4-enylsulfonylpent-1-ene has a molecular weight of 202.32 g/mol, XLogP of 2.33, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pent-4-enylsulfonylpent-1-ene is sourced from PubChem (CID 11506665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).