5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide

C7H10FNO4S2 — CID 146571389

IUPAC5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide
SMILESCC(O)(CO)c1cc(F)c(S(N)(=O)=O)s1
InChIInChI=1S/C7H10FNO4S2/c1-7(11,3-10)5-2-4(8)6(14-5)15(9,12)13/h2,10-11H,3H2,1H3,(H2,9,12,13)
InChIKeyZYJAIIQOYVGDAM-UHFFFAOYSA-N
MW255.29 g/mol
LogP-0.27
Rot. Bonds3

About 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide

5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide (PubChem CID 146571389) has the molecular formula C7H10FNO4S2 and a molecular weight of 255.29 g/mol. Its IUPAC name is 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide
PubChem CID146571389
Molecular FormulaC7H10FNO4S2
Molecular Weight255.29 g/mol
Exact Mass255.00
IUPAC Name5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide
SMILESCC(O)(CO)c1cc(F)c(S(N)(=O)=O)s1
InChIInChI=1S/C7H10FNO4S2/c1-7(11,3-10)5-2-4(8)6(14-5)15(9,12)13/h2,10-11H,3H2,1H3,(H2,9,12,13)
InChIKeyZYJAIIQOYVGDAM-UHFFFAOYSA-N
XLogP-0.27
TPSA100.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Fluoro-5-(2-hydroxypropan-2-yl)thiophene-2-sulfonamide
CID 137459115
3-Fluoro-5-(2-hydroxypropan-2-yl)thiophene-2-sulfinamide
CID 142522466
[Amino-[3-fluoro-5-(2-hydroxypropan-2-yl)thiophen-2-yl]-oxo-lambda6-sulfanylidene]carbamic acid
CID 146570500
3-Fluoro-5-(2-hydroxypropan-2-yl)thiophene-2-sulfinic acid
CID 146570527
(S)-3-fluoro-5-(2-hydroxypropan-2-yl)thiophene-2-sulfinamide
CID 146570551
[3-Fluoro-5-(2-hydroxypropan-2-yl)thiophen-2-yl]sulfinylcarbamic acid
CID 146570580
2-[5-(Aminosulfonimidoyl)-4-fluorothiophen-2-yl]propan-2-ol
CID 146571381
5-[(2S)-1,2-dihydroxypropan-2-yl]-3-fluorothiophene-2-sulfonamide
CID 146571390
[Amino-[3-fluoro-5-(2-hydroxypropan-2-yl)thiophen-2-yl]-oxo-lambda6-sulfanylidene]urea
CID 146617477
4-Fluoro-5-(2-hydroxypropan-2-yl)thiophene-2-sulfinamide
CID 146618217
4-Fluoro-5-(2-hydroxypropan-2-yl)thiophene-2-sulfonamide
CID 146618219
5-[(2R)-1,2-dihydroxypropan-2-yl]-3-fluorothiophene-2-sulfonamide
CID 146618228

Frequently Asked Questions

What is the IUPAC name of 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide?
The IUPAC name of 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide (CID 146571389) is 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide.
What is the SMILES notation for 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide?
The canonical SMILES for 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide is CC(O)(CO)c1cc(F)c(S(N)(=O)=O)s1.
What is the InChIKey of 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide?
The InChIKey is ZYJAIIQOYVGDAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FNO4S2/c1-7(11,3-10)5-2-4(8)6(14-5)15(9,12)13/h2,10-11H,3H2,1H3,(H2,9,12,13).
What are the key properties of 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide?
5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide has a molecular weight of 255.29 g/mol, XLogP of -0.27, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2-dihydroxypropan-2-yl)-3-fluorothiophene-2-sulfonamide is sourced from PubChem (CID 146571389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).