5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide

C10H12N2O3S2 — CID 53111967

IUPAC5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide
SMILESCC(C)NS(=O)(=O)c1ccc(-c2ccno2)s1
InChIInChI=1S/C10H12N2O3S2/c1-7(2)12-17(13,14)10-4-3-9(16-10)8-5-6-11-15-8/h3-7,12H,1-2H3
InChIKeyLTIMTFKHDCZIQI-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.09
Rot. Bonds4

About 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide

5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide (PubChem CID 53111967) has the molecular formula C10H12N2O3S2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide
PubChem CID53111967
Molecular FormulaC10H12N2O3S2
Molecular Weight272.35 g/mol
Exact Mass272.03
IUPAC Name5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide
SMILESCC(C)NS(=O)(=O)c1ccc(-c2ccno2)s1
InChIInChI=1S/C10H12N2O3S2/c1-7(2)12-17(13,14)10-4-3-9(16-10)8-5-6-11-15-8/h3-7,12H,1-2H3
InChIKeyLTIMTFKHDCZIQI-UHFFFAOYSA-N
XLogP2.09
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide?
The IUPAC name of 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide (CID 53111967) is 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide.
What is the SMILES notation for 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide?
The canonical SMILES for 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide is CC(C)NS(=O)(=O)c1ccc(-c2ccno2)s1.
What is the InChIKey of 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide?
The InChIKey is LTIMTFKHDCZIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3S2/c1-7(2)12-17(13,14)10-4-3-9(16-10)8-5-6-11-15-8/h3-7,12H,1-2H3.
What are the key properties of 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide?
5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide has a molecular weight of 272.35 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide is sourced from PubChem (CID 53111967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).