2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide

C15H18N2O4S — CID 2443198

IUPAC2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide
SMILESCc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c(C)o1
InChIInChI=1S/C15H18N2O4S/c1-10-9-14(11(2)21-10)15(18)17-8-7-12-3-5-13(6-4-12)22(16,19)20/h3-6,9H,7-8H2,1-2H3,(H,17,18)(H2,16,19,20)
InChIKeyUGQAZCRQMBIGMG-UHFFFAOYSA-N
MW322.39 g/mol
LogP1.52
Rot. Bonds5

About 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide

2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide (PubChem CID 2443198) has the molecular formula C15H18N2O4S and a molecular weight of 322.39 g/mol. Its IUPAC name is 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide
PubChem CID2443198
Molecular FormulaC15H18N2O4S
Molecular Weight322.39 g/mol
Exact Mass322.10
IUPAC Name2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide
SMILESCc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c(C)o1
InChIInChI=1S/C15H18N2O4S/c1-10-9-14(11(2)21-10)15(18)17-8-7-12-3-5-13(6-4-12)22(16,19)20/h3-6,9H,7-8H2,1-2H3,(H,17,18)(H2,16,19,20)
InChIKeyUGQAZCRQMBIGMG-UHFFFAOYSA-N
XLogP1.52
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide 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 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide (CID 2443198) is 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide is Cc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide?
The InChIKey is UGQAZCRQMBIGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S/c1-10-9-14(11(2)21-10)15(18)17-8-7-12-3-5-13(6-4-12)22(16,19)20/h3-6,9H,7-8H2,1-2H3,(H,17,18)(H2,16,19,20).
What are the key properties of 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide?
2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide has a molecular weight of 322.39 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide is sourced from PubChem (CID 2443198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).