2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide

C11H11FN2O2S2 — CID 71870447

IUPAC2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)N(C)c2nccs2)c(F)c1
InChIInChI=1S/C11H11FN2O2S2/c1-8-3-4-10(9(12)7-8)18(15,16)14(2)11-13-5-6-17-11/h3-7H,1-2H3
InChIKeyPIQFHGOKYCYFEJ-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.42
Rot. Bonds3

About 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide

2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide (PubChem CID 71870447) has the molecular formula C11H11FN2O2S2 and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
PubChem CID71870447
Molecular FormulaC11H11FN2O2S2
Molecular Weight286.35 g/mol
Exact Mass286.02
IUPAC Name2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)N(C)c2nccs2)c(F)c1
InChIInChI=1S/C11H11FN2O2S2/c1-8-3-4-10(9(12)7-8)18(15,16)14(2)11-13-5-6-17-11/h3-7H,1-2H3
InChIKeyPIQFHGOKYCYFEJ-UHFFFAOYSA-N
XLogP2.42
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The IUPAC name of 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide (CID 71870447) is 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide.
What is the SMILES notation for 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The canonical SMILES for 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide is Cc1ccc(S(=O)(=O)N(C)c2nccs2)c(F)c1.
What is the InChIKey of 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The InChIKey is PIQFHGOKYCYFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2S2/c1-8-3-4-10(9(12)7-8)18(15,16)14(2)11-13-5-6-17-11/h3-7H,1-2H3.
What are the key properties of 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide has a molecular weight of 286.35 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,4-dimethyl-N-(1,3-thiazol-2-yl)benzenesulfonamide is sourced from PubChem (CID 71870447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).