(E)-2-fluoro-N-propan-2-ylethenesulfonamide

C5H10FNO2S — CID 134403173

IUPAC(E)-2-fluoro-N-propan-2-ylethenesulfonamide
SMILESCC(C)NS(=O)(=O)/C=C/F
InChIInChI=1S/C5H10FNO2S/c1-5(2)7-10(8,9)4-3-6/h3-5,7H,1-2H3/b4-3+
InChIKeyWGFSYFKPTSZEOK-ONEGZZNKSA-N
MW167.20 g/mol
LogP0.75
Rot. Bonds3

About (E)-2-fluoro-N-propan-2-ylethenesulfonamide

(E)-2-fluoro-N-propan-2-ylethenesulfonamide (PubChem CID 134403173) has the molecular formula C5H10FNO2S and a molecular weight of 167.20 g/mol. Its IUPAC name is (E)-2-fluoro-N-propan-2-ylethenesulfonamide.

Molecular Properties

Compound Name(E)-2-fluoro-N-propan-2-ylethenesulfonamide
PubChem CID134403173
Molecular FormulaC5H10FNO2S
Molecular Weight167.20 g/mol
Exact Mass167.04
IUPAC Name(E)-2-fluoro-N-propan-2-ylethenesulfonamide
SMILESCC(C)NS(=O)(=O)/C=C/F
InChIInChI=1S/C5H10FNO2S/c1-5(2)7-10(8,9)4-3-6/h3-5,7H,1-2H3/b4-3+
InChIKeyWGFSYFKPTSZEOK-ONEGZZNKSA-N
XLogP0.75
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.20
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-2-fluoro-N-propan-2-ylethenesulfonamide?
The IUPAC name of (E)-2-fluoro-N-propan-2-ylethenesulfonamide (CID 134403173) is (E)-2-fluoro-N-propan-2-ylethenesulfonamide.
What is the SMILES notation for (E)-2-fluoro-N-propan-2-ylethenesulfonamide?
The canonical SMILES for (E)-2-fluoro-N-propan-2-ylethenesulfonamide is CC(C)NS(=O)(=O)/C=C/F.
What is the InChIKey of (E)-2-fluoro-N-propan-2-ylethenesulfonamide?
The InChIKey is WGFSYFKPTSZEOK-ONEGZZNKSA-N. The full InChI is InChI=1S/C5H10FNO2S/c1-5(2)7-10(8,9)4-3-6/h3-5,7H,1-2H3/b4-3+.
What are the key properties of (E)-2-fluoro-N-propan-2-ylethenesulfonamide?
(E)-2-fluoro-N-propan-2-ylethenesulfonamide has a molecular weight of 167.20 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-fluoro-N-propan-2-ylethenesulfonamide is sourced from PubChem (CID 134403173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).