2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide

C13H12N2O4S2 — CID 46292566

IUPAC2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide
SMILESCc1oc(-c2ccno2)cc1S(=O)(=O)NCc1cccs1
InChIInChI=1S/C13H12N2O4S2/c1-9-13(7-12(18-9)11-4-5-14-19-11)21(16,17)15-8-10-3-2-6-20-10/h2-7,15H,8H2,1H3
InChIKeyYXCWNCKMZXHUMZ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.78
Rot. Bonds5

About 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide

2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide (PubChem CID 46292566) has the molecular formula C13H12N2O4S2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide.

Molecular Properties

Compound Name2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide
PubChem CID46292566
Molecular FormulaC13H12N2O4S2
Molecular Weight324.38 g/mol
Exact Mass324.02
IUPAC Name2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide
SMILESCc1oc(-c2ccno2)cc1S(=O)(=O)NCc1cccs1
InChIInChI=1S/C13H12N2O4S2/c1-9-13(7-12(18-9)11-4-5-14-19-11)21(16,17)15-8-10-3-2-6-20-10/h2-7,15H,8H2,1H3
InChIKeyYXCWNCKMZXHUMZ-UHFFFAOYSA-N
XLogP2.78
TPSA85.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-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

N-(furan-2-ylmethyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292504
5-methyl-4-(thiophen-2-ylmethylsulfamoyl)furan-2-carboxylic acid
CID 62803440
N-(3-chlorophenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292481
N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292588
N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292577
N-(4-chloro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292486
2,5-dimethoxy-4-methyl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 6457434
N-(thiophen-2-ylmethyl)-3-[3-(thiophen-2-ylmethylsulfamoyl)phenyl]sulfonylbenzenesulfonamide
CID 3453501
3-amino-5-bromo-2-methyl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 114378807
2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 62143225
3-methyl-1-propan-2-yl-N-(thiophen-2-ylmethyl)pyrazole-4-sulfonamide
CID 42282427
N-[4-methyl-3-(thiophen-2-ylmethylsulfamoyl)phenyl]acetamide
CID 39792806

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide?
The IUPAC name of 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide (CID 46292566) is 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide.
What is the SMILES notation for 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide?
The canonical SMILES for 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide is Cc1oc(-c2ccno2)cc1S(=O)(=O)NCc1cccs1.
What is the InChIKey of 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide?
The InChIKey is YXCWNCKMZXHUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O4S2/c1-9-13(7-12(18-9)11-4-5-14-19-11)21(16,17)15-8-10-3-2-6-20-10/h2-7,15H,8H2,1H3.
What are the key properties of 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide?
2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide has a molecular weight of 324.38 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide is sourced from PubChem (CID 46292566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).