N-propylethenesulfonamide

C5H11NO2S — CID 19883900

IUPACN-propylethenesulfonamide
SMILESC=CS(=O)(=O)NCCC
InChIInChI=1S/C5H11NO2S/c1-3-5-6-9(7,8)4-2/h4,6H,2-3,5H2,1H3
InChIKeyTYIDPQQUJIPRBU-UHFFFAOYSA-N
MW149.22 g/mol
LogP0.46
Rot. Bonds4

About N-propylethenesulfonamide

N-propylethenesulfonamide (PubChem CID 19883900) has the molecular formula C5H11NO2S and a molecular weight of 149.22 g/mol. Its IUPAC name is N-propylethenesulfonamide.

Molecular Properties

Compound NameN-propylethenesulfonamide
PubChem CID19883900
Molecular FormulaC5H11NO2S
Molecular Weight149.22 g/mol
Exact Mass149.05
IUPAC NameN-propylethenesulfonamide
SMILESC=CS(=O)(=O)NCCC
InChIInChI=1S/C5H11NO2S/c1-3-5-6-9(7,8)4-2/h4,6H,2-3,5H2,1H3
InChIKeyTYIDPQQUJIPRBU-UHFFFAOYSA-N
XLogP0.46
TPSA46.17 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 ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propylethenesulfonamide?
The IUPAC name of N-propylethenesulfonamide (CID 19883900) is N-propylethenesulfonamide.
What is the SMILES notation for N-propylethenesulfonamide?
The canonical SMILES for N-propylethenesulfonamide is C=CS(=O)(=O)NCCC.
What is the InChIKey of N-propylethenesulfonamide?
The InChIKey is TYIDPQQUJIPRBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2S/c1-3-5-6-9(7,8)4-2/h4,6H,2-3,5H2,1H3.
What are the key properties of N-propylethenesulfonamide?
N-propylethenesulfonamide has a molecular weight of 149.22 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylethenesulfonamide is sourced from PubChem (CID 19883900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).