3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide

C7H8FNO2S2 — CID 163997313

IUPAC3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide
SMILESC=C(C)c1cc(F)c(S(N)(=O)=O)s1
InChIInChI=1S/C7H8FNO2S2/c1-4(2)6-3-5(8)7(12-6)13(9,10)11/h3H,1H2,2H3,(H2,9,10,11)
InChIKeyUFVRNRIFERZPDA-UHFFFAOYSA-N
MW221.28 g/mol
LogP1.57
Rot. Bonds2

About 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide

3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide (PubChem CID 163997313) has the molecular formula C7H8FNO2S2 and a molecular weight of 221.28 g/mol. Its IUPAC name is 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide
PubChem CID163997313
Molecular FormulaC7H8FNO2S2
Molecular Weight221.28 g/mol
Exact Mass221.00
IUPAC Name3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide
SMILESC=C(C)c1cc(F)c(S(N)(=O)=O)s1
InChIInChI=1S/C7H8FNO2S2/c1-4(2)6-3-5(8)7(12-6)13(9,10)11/h3H,1H2,2H3,(H2,9,10,11)
InChIKeyUFVRNRIFERZPDA-UHFFFAOYSA-N
XLogP1.57
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide?
The IUPAC name of 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide (CID 163997313) is 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide.
What is the SMILES notation for 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide?
The canonical SMILES for 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide is C=C(C)c1cc(F)c(S(N)(=O)=O)s1.
What is the InChIKey of 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide?
The InChIKey is UFVRNRIFERZPDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO2S2/c1-4(2)6-3-5(8)7(12-6)13(9,10)11/h3H,1H2,2H3,(H2,9,10,11).
What are the key properties of 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide?
3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide has a molecular weight of 221.28 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-prop-1-en-2-ylthiophene-2-sulfonamide is sourced from PubChem (CID 163997313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).