N-prop-2-enylprop-2-ene-1-sulfonamide

C6H11NO2S — CID 15418407

IUPACN-prop-2-enylprop-2-ene-1-sulfonamide
SMILESC=CCNS(=O)(=O)CC=C
InChIInChI=1S/C6H11NO2S/c1-3-5-7-10(8,9)6-4-2/h3-4,7H,1-2,5-6H2
InChIKeyHELZKZIMLLZJIS-UHFFFAOYSA-N
MW161.23 g/mol
LogP0.28
Rot. Bonds5

About N-prop-2-enylprop-2-ene-1-sulfonamide

N-prop-2-enylprop-2-ene-1-sulfonamide (PubChem CID 15418407) has the molecular formula C6H11NO2S and a molecular weight of 161.23 g/mol. Its IUPAC name is N-prop-2-enylprop-2-ene-1-sulfonamide.

Molecular Properties

Compound NameN-prop-2-enylprop-2-ene-1-sulfonamide
PubChem CID15418407
Molecular FormulaC6H11NO2S
Molecular Weight161.23 g/mol
Exact Mass161.05
IUPAC NameN-prop-2-enylprop-2-ene-1-sulfonamide
SMILESC=CCNS(=O)(=O)CC=C
InChIInChI=1S/C6H11NO2S/c1-3-5-7-10(8,9)6-4-2/h3-4,7H,1-2,5-6H2
InChIKeyHELZKZIMLLZJIS-UHFFFAOYSA-N
XLogP0.28
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.23
LogP ≤ 50.28
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-prop-2-enylprop-2-ene-1-sulfonamide?
The IUPAC name of N-prop-2-enylprop-2-ene-1-sulfonamide (CID 15418407) is N-prop-2-enylprop-2-ene-1-sulfonamide.
What is the SMILES notation for N-prop-2-enylprop-2-ene-1-sulfonamide?
The canonical SMILES for N-prop-2-enylprop-2-ene-1-sulfonamide is C=CCNS(=O)(=O)CC=C.
What is the InChIKey of N-prop-2-enylprop-2-ene-1-sulfonamide?
The InChIKey is HELZKZIMLLZJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2S/c1-3-5-7-10(8,9)6-4-2/h3-4,7H,1-2,5-6H2.
What are the key properties of N-prop-2-enylprop-2-ene-1-sulfonamide?
N-prop-2-enylprop-2-ene-1-sulfonamide has a molecular weight of 161.23 g/mol, XLogP of 0.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enylprop-2-ene-1-sulfonamide is sourced from PubChem (CID 15418407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).