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

C17H19N3O4S — CID 110632442

IUPAC4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide
SMILESCc1cc(CCNS(=O)(=O)c2ccc(-c3nc(C)oc3C)cc2)no1
InChIInChI=1S/C17H19N3O4S/c1-11-10-15(20-24-11)8-9-18-25(21,22)16-6-4-14(5-7-16)17-12(2)23-13(3)19-17/h4-7,10,18H,8-9H2,1-3H3
InChIKeyOKNZTSHJLGZQQG-UHFFFAOYSA-N
MW361.42 g/mol
LogP2.78
Rot. Bonds6

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

4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide (PubChem CID 110632442) has the molecular formula C17H19N3O4S and a molecular weight of 361.42 g/mol. Its IUPAC name is 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide
PubChem CID110632442
Molecular FormulaC17H19N3O4S
Molecular Weight361.42 g/mol
Exact Mass361.11
IUPAC Name4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide
SMILESCc1cc(CCNS(=O)(=O)c2ccc(-c3nc(C)oc3C)cc2)no1
InChIInChI=1S/C17H19N3O4S/c1-11-10-15(20-24-11)8-9-18-25(21,22)16-6-4-14(5-7-16)17-12(2)23-13(3)19-17/h4-7,10,18H,8-9H2,1-3H3
InChIKeyOKNZTSHJLGZQQG-UHFFFAOYSA-N
XLogP2.78
TPSA98.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide with MolForge

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Related Compounds

4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 110675358
4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-(3-phenylpropyl)benzenesulfonamide
CID 110414948
N-[2-(diethylamino)propyl]-4-(2,5-dimethyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 110620380
4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-methoxybenzenesulfonamide
CID 110611820
N-[4-(2,5-dimethyl-1,3-oxazol-4-yl)phenyl]-3,4-dimethylbenzenesulfonamide
CID 110417093
N-[(3-cyclopropyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-4-(2,5-dimethyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 110634121
N-[4-(2,5-dimethyl-1,3-oxazol-4-yl)phenyl]-4-propan-2-ylbenzenesulfonamide
CID 110417096
N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]cyclopentanesulfonamide
CID 110310834
4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-(3-methoxyphenyl)benzenesulfonamide
CID 110421983
4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-(2-propan-2-ylphenyl)benzenesulfonamide
CID 110419289
4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-(2-methoxyphenyl)benzenesulfonamide
CID 110421910
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 91907142

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide?
The IUPAC name of 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide (CID 110632442) is 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide is Cc1cc(CCNS(=O)(=O)c2ccc(-c3nc(C)oc3C)cc2)no1.
What is the InChIKey of 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide?
The InChIKey is OKNZTSHJLGZQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4S/c1-11-10-15(20-24-11)8-9-18-25(21,22)16-6-4-14(5-7-16)17-12(2)23-13(3)19-17/h4-7,10,18H,8-9H2,1-3H3.
What are the key properties of 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide?
4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide has a molecular weight of 361.42 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethyl-1,3-oxazol-4-yl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 110632442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).