N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide

C11H14N2O3S2 — CID 6464902

IUPACN-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide
SMILESCC(C)(C)c1cc(NS(=O)(=O)c2cccs2)no1
InChIInChI=1S/C11H14N2O3S2/c1-11(2,3)8-7-9(12-16-8)13-18(14,15)10-5-4-6-17-10/h4-7H,1-3H3,(H,12,13)
InChIKeyJIEJNCFZOPYYEN-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.83
Rot. Bonds3

About N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide

N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide (PubChem CID 6464902) has the molecular formula C11H14N2O3S2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide
PubChem CID6464902
Molecular FormulaC11H14N2O3S2
Molecular Weight286.38 g/mol
Exact Mass286.04
IUPAC NameN-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide
SMILESCC(C)(C)c1cc(NS(=O)(=O)c2cccs2)no1
InChIInChI=1S/C11H14N2O3S2/c1-11(2,3)8-7-9(12-16-8)13-18(14,15)10-5-4-6-17-10/h4-7H,1-3H3,(H,12,13)
InChIKeyJIEJNCFZOPYYEN-UHFFFAOYSA-N
XLogP2.83
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide (CID 6464902) is N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide is CC(C)(C)c1cc(NS(=O)(=O)c2cccs2)no1.
What is the InChIKey of N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide?
The InChIKey is JIEJNCFZOPYYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3S2/c1-11(2,3)8-7-9(12-16-8)13-18(14,15)10-5-4-6-17-10/h4-7H,1-3H3,(H,12,13).
What are the key properties of N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide?
N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide has a molecular weight of 286.38 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1,2-oxazol-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 6464902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).