(E)-2-phenyl-N-propylethenesulfonamide

C11H15NO2S — CID 2470551

IUPAC(E)-2-phenyl-N-propylethenesulfonamide
SMILESCCCNS(=O)(=O)/C=C/c1ccccc1
InChIInChI=1S/C11H15NO2S/c1-2-9-12-15(13,14)10-8-11-6-4-3-5-7-11/h3-8,10,12H,2,9H2,1H3/b10-8+
InChIKeyXZBIJUUPQUTJNW-CSKARUKUSA-N
MW225.31 g/mol
LogP1.99
Rot. Bonds5

About (E)-2-phenyl-N-propylethenesulfonamide

(E)-2-phenyl-N-propylethenesulfonamide (PubChem CID 2470551) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is (E)-2-phenyl-N-propylethenesulfonamide.

Molecular Properties

Compound Name(E)-2-phenyl-N-propylethenesulfonamide
PubChem CID2470551
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name(E)-2-phenyl-N-propylethenesulfonamide
SMILESCCCNS(=O)(=O)/C=C/c1ccccc1
InChIInChI=1S/C11H15NO2S/c1-2-9-12-15(13,14)10-8-11-6-4-3-5-7-11/h3-8,10,12H,2,9H2,1H3/b10-8+
InChIKeyXZBIJUUPQUTJNW-CSKARUKUSA-N
XLogP1.99
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-2-phenyl-N-propylethenesulfonamide?
The IUPAC name of (E)-2-phenyl-N-propylethenesulfonamide (CID 2470551) is (E)-2-phenyl-N-propylethenesulfonamide.
What is the SMILES notation for (E)-2-phenyl-N-propylethenesulfonamide?
The canonical SMILES for (E)-2-phenyl-N-propylethenesulfonamide is CCCNS(=O)(=O)/C=C/c1ccccc1.
What is the InChIKey of (E)-2-phenyl-N-propylethenesulfonamide?
The InChIKey is XZBIJUUPQUTJNW-CSKARUKUSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-2-9-12-15(13,14)10-8-11-6-4-3-5-7-11/h3-8,10,12H,2,9H2,1H3/b10-8+.
What are the key properties of (E)-2-phenyl-N-propylethenesulfonamide?
(E)-2-phenyl-N-propylethenesulfonamide has a molecular weight of 225.31 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-phenyl-N-propylethenesulfonamide is sourced from PubChem (CID 2470551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).