pent-4-ene-1-sulfonamide

C5H11NO2S — CID 11788380

IUPACpent-4-ene-1-sulfonamide
SMILESC=CCCCS(N)(=O)=O
InChIInChI=1S/C5H11NO2S/c1-2-3-4-5-9(6,7)8/h2H,1,3-5H2,(H2,6,7,8)
InChIKeyGUYDOCPILYZNEK-UHFFFAOYSA-N
MW149.22 g/mol
LogP0.24
Rot. Bonds4

About pent-4-ene-1-sulfonamide

pent-4-ene-1-sulfonamide (PubChem CID 11788380) has the molecular formula C5H11NO2S and a molecular weight of 149.22 g/mol. Its IUPAC name is pent-4-ene-1-sulfonamide.

Molecular Properties

Compound Namepent-4-ene-1-sulfonamide
PubChem CID11788380
Molecular FormulaC5H11NO2S
Molecular Weight149.22 g/mol
Exact Mass149.05
IUPAC Namepent-4-ene-1-sulfonamide
SMILESC=CCCCS(N)(=O)=O
InChIInChI=1S/C5H11NO2S/c1-2-3-4-5-9(6,7)8/h2H,1,3-5H2,(H2,6,7,8)
InChIKeyGUYDOCPILYZNEK-UHFFFAOYSA-N
XLogP0.24
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.22
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dodecane-1,12-disulfonamide
CID 57288842
azanium hex-5-ene-1-sulfonate
CID 155661740
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
4-hydroxybutane-1-sulfonamide
CID 21436386
4-ethylsulfonylbut-1-ene
CID 57039328
4-chlorobutane-1-sulfonamide
CID 18461
chloromethane;prop-2-ene-1-sulfonamide
CID 174937700
butane-1-sulfonamide;dihydrochloride
CID 140980497
CID 175918224
CID 175918224
2-(prop-2-enylamino)-N-(3-sulfamoylpropyl)acetamide
CID 79280560
pent-4-ene-1-sulfonic acid;pyridine
CID 174535826

Frequently Asked Questions

What is the IUPAC name of pent-4-ene-1-sulfonamide?
The IUPAC name of pent-4-ene-1-sulfonamide (CID 11788380) is pent-4-ene-1-sulfonamide.
What is the SMILES notation for pent-4-ene-1-sulfonamide?
The canonical SMILES for pent-4-ene-1-sulfonamide is C=CCCCS(N)(=O)=O.
What is the InChIKey of pent-4-ene-1-sulfonamide?
The InChIKey is GUYDOCPILYZNEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2S/c1-2-3-4-5-9(6,7)8/h2H,1,3-5H2,(H2,6,7,8).
What are the key properties of pent-4-ene-1-sulfonamide?
pent-4-ene-1-sulfonamide has a molecular weight of 149.22 g/mol, XLogP of 0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pent-4-ene-1-sulfonamide is sourced from PubChem (CID 11788380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).