4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide

C14H18N2O4S — CID 90537808

IUPAC4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NCCc2cc(C)no2)cc1
InChIInChI=1S/C14H18N2O4S/c1-3-19-12-4-6-14(7-5-12)21(17,18)15-9-8-13-10-11(2)16-20-13/h4-7,10,15H,3,8-9H2,1-2H3
InChIKeyLIGKUEFZRWATGQ-UHFFFAOYSA-N
MW310.38 g/mol
LogP1.90
Rot. Bonds7

About 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide

4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide (PubChem CID 90537808) has the molecular formula C14H18N2O4S and a molecular weight of 310.38 g/mol. Its IUPAC name is 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide
PubChem CID90537808
Molecular FormulaC14H18N2O4S
Molecular Weight310.38 g/mol
Exact Mass310.10
IUPAC Name4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NCCc2cc(C)no2)cc1
InChIInChI=1S/C14H18N2O4S/c1-3-19-12-4-6-14(7-5-12)21(17,18)15-9-8-13-10-11(2)16-20-13/h4-7,10,15H,3,8-9H2,1-2H3
InChIKeyLIGKUEFZRWATGQ-UHFFFAOYSA-N
XLogP1.90
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]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

4-acetyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide
CID 71789762
5-ethyl-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]thiophene-2-sulfonamide
CID 90537815
4-ethoxy-N-[2-(methylamino)ethyl]benzenesulfonamide
CID 62657994
4-[2-[(4-ethoxyphenyl)sulfonylamino]ethyl]benzenesulfonamide
CID 2442104
4-ethoxy-N-[(6-methylpyrimidin-4-yl)methyl]benzenesulfonamide
CID 122263634
4-ethoxy-N-[3-(furan-2-yl)propyl]benzenesulfonamide
CID 53279766
N-[2-(dimethylamino)ethyl]-4-ethoxybenzenesulfonamide
CID 7528966
4-ethoxy-N-(3-hydroxypropyl)benzenesulfonamide
CID 6460242
4-ethoxy-N-[2-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)ethyl]benzenesulfonamide
CID 110323282
N-(4,6-dimethylpyrimidin-2-yl)-4-ethoxybenzenesulfonamide
CID 22202469
N-[2-(4-ethoxyphenoxy)ethyl]-4-methoxybenzenesulfonamide
CID 40753909
N-[3-(dimethylamino)propyl]-4-ethoxybenzenesulfonamide
CID 4790143

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide (CID 90537808) is 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide is CCOc1ccc(S(=O)(=O)NCCc2cc(C)no2)cc1.
What is the InChIKey of 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide?
The InChIKey is LIGKUEFZRWATGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4S/c1-3-19-12-4-6-14(7-5-12)21(17,18)15-9-8-13-10-11(2)16-20-13/h4-7,10,15H,3,8-9H2,1-2H3.
What are the key properties of 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide?
4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide has a molecular weight of 310.38 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 90537808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).