5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide

C15H13FN2O4S — CID 53085877

IUPAC5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide
SMILESCc1noc(-c2ccc(S(=O)(=O)Nc3ccccc3F)o2)c1C
InChIInChI=1S/C15H13FN2O4S/c1-9-10(2)17-22-15(9)13-7-8-14(21-13)23(19,20)18-12-6-4-3-5-11(12)16/h3-8,18H,1-2H3
InChIKeyKYFGFESQFIOVSI-UHFFFAOYSA-N
MW336.34 g/mol
LogP3.49
Rot. Bonds4

About 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide

5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide (PubChem CID 53085877) has the molecular formula C15H13FN2O4S and a molecular weight of 336.34 g/mol. Its IUPAC name is 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide
PubChem CID53085877
Molecular FormulaC15H13FN2O4S
Molecular Weight336.34 g/mol
Exact Mass336.06
IUPAC Name5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide
SMILESCc1noc(-c2ccc(S(=O)(=O)Nc3ccccc3F)o2)c1C
InChIInChI=1S/C15H13FN2O4S/c1-9-10(2)17-22-15(9)13-7-8-14(21-13)23(19,20)18-12-6-4-3-5-11(12)16/h3-8,18H,1-2H3
InChIKeyKYFGFESQFIOVSI-UHFFFAOYSA-N
XLogP3.49
TPSA85.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.34
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-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

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide?
The IUPAC name of 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide (CID 53085877) is 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide?
The canonical SMILES for 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide is Cc1noc(-c2ccc(S(=O)(=O)Nc3ccccc3F)o2)c1C.
What is the InChIKey of 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide?
The InChIKey is KYFGFESQFIOVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O4S/c1-9-10(2)17-22-15(9)13-7-8-14(21-13)23(19,20)18-12-6-4-3-5-11(12)16/h3-8,18H,1-2H3.
What are the key properties of 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide?
5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide has a molecular weight of 336.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(2-fluorophenyl)furan-2-sulfonamide is sourced from PubChem (CID 53085877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).