2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide

C13H14FNO2S2 — CID 47358916

IUPAC2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
SMILESCC(Cc1ccsc1)NS(=O)(=O)c1ccccc1F
InChIInChI=1S/C13H14FNO2S2/c1-10(8-11-6-7-18-9-11)15-19(16,17)13-5-3-2-4-12(13)14/h2-7,9-10,15H,8H2,1H3
InChIKeyMTWWVXZPRNMTDY-UHFFFAOYSA-N
MW299.39 g/mol
LogP2.80
Rot. Bonds5

About 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide

2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide (PubChem CID 47358916) has the molecular formula C13H14FNO2S2 and a molecular weight of 299.39 g/mol. Its IUPAC name is 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
PubChem CID47358916
Molecular FormulaC13H14FNO2S2
Molecular Weight299.39 g/mol
Exact Mass299.04
IUPAC Name2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
SMILESCC(Cc1ccsc1)NS(=O)(=O)c1ccccc1F
InChIInChI=1S/C13H14FNO2S2/c1-10(8-11-6-7-18-9-11)15-19(16,17)13-5-3-2-4-12(13)14/h2-7,9-10,15H,8H2,1H3
InChIKeyMTWWVXZPRNMTDY-UHFFFAOYSA-N
XLogP2.80
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.39
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-N-(1-thiophen-3-ylpropan-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

Related Compounds

2-(methylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 62152021
2-(aminomethyl)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 106053233
2-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474983
5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474831
5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 54954014
4-(bromomethyl)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 65479835
2-(difluoromethylsulfonyl)-N-(1-thiophen-3-ylpropan-2-yl)aniline
CID 61474487
2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-(thiophen-3-ylmethyl)butanamide
CID 55689276
5-bromo-2-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
CID 61223337
3-amino-1-ethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazole-4-sulfonamide
CID 61474909
3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
CID 103305478
4-bromo-2,6-dichloro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 63420478

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
The IUPAC name of 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide (CID 47358916) is 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide.
What is the SMILES notation for 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
The canonical SMILES for 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide is CC(Cc1ccsc1)NS(=O)(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
The InChIKey is MTWWVXZPRNMTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO2S2/c1-10(8-11-6-7-18-9-11)15-19(16,17)13-5-3-2-4-12(13)14/h2-7,9-10,15H,8H2,1H3.
What are the key properties of 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide has a molecular weight of 299.39 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide is sourced from PubChem (CID 47358916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).