3-cyclopentyl-1,2-oxazole-5-sulfonamide

C8H12N2O3S — CID 167728142

IUPAC3-cyclopentyl-1,2-oxazole-5-sulfonamide
SMILESNS(=O)(=O)c1cc(C2CCCC2)no1
InChIInChI=1S/C8H12N2O3S/c9-14(11,12)8-5-7(10-13-8)6-3-1-2-4-6/h5-6H,1-4H2,(H2,9,11,12)
InChIKeyWZQNNGBVYFNBSY-UHFFFAOYSA-N
MW216.26 g/mol
LogP0.98
Rot. Bonds2

About 3-cyclopentyl-1,2-oxazole-5-sulfonamide

3-cyclopentyl-1,2-oxazole-5-sulfonamide (PubChem CID 167728142) has the molecular formula C8H12N2O3S and a molecular weight of 216.26 g/mol. Its IUPAC name is 3-cyclopentyl-1,2-oxazole-5-sulfonamide.

Molecular Properties

Compound Name3-cyclopentyl-1,2-oxazole-5-sulfonamide
PubChem CID167728142
Molecular FormulaC8H12N2O3S
Molecular Weight216.26 g/mol
Exact Mass216.06
IUPAC Name3-cyclopentyl-1,2-oxazole-5-sulfonamide
SMILESNS(=O)(=O)c1cc(C2CCCC2)no1
InChIInChI=1S/C8H12N2O3S/c9-14(11,12)8-5-7(10-13-8)6-3-1-2-4-6/h5-6H,1-4H2,(H2,9,11,12)
InChIKeyWZQNNGBVYFNBSY-UHFFFAOYSA-N
XLogP0.98
TPSA86.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1,2-oxazole-5-sulfonamide?
The IUPAC name of 3-cyclopentyl-1,2-oxazole-5-sulfonamide (CID 167728142) is 3-cyclopentyl-1,2-oxazole-5-sulfonamide.
What is the SMILES notation for 3-cyclopentyl-1,2-oxazole-5-sulfonamide?
The canonical SMILES for 3-cyclopentyl-1,2-oxazole-5-sulfonamide is NS(=O)(=O)c1cc(C2CCCC2)no1.
What is the InChIKey of 3-cyclopentyl-1,2-oxazole-5-sulfonamide?
The InChIKey is WZQNNGBVYFNBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3S/c9-14(11,12)8-5-7(10-13-8)6-3-1-2-4-6/h5-6H,1-4H2,(H2,9,11,12).
What are the key properties of 3-cyclopentyl-1,2-oxazole-5-sulfonamide?
3-cyclopentyl-1,2-oxazole-5-sulfonamide has a molecular weight of 216.26 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1,2-oxazole-5-sulfonamide is sourced from PubChem (CID 167728142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).