N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide

C7H11N3O3S — CID 64587060

IUPACN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C7H11N3O3S/c1-2-14(11,12)10-7-9-8-6(13-7)5-3-4-5/h5H,2-4H2,1H3,(H,9,10)
InChIKeyXBSJEPKFFNQNCB-UHFFFAOYSA-N
MW217.25 g/mol
LogP0.71
Rot. Bonds4

About N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide

N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide (PubChem CID 64587060) has the molecular formula C7H11N3O3S and a molecular weight of 217.25 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide
PubChem CID64587060
Molecular FormulaC7H11N3O3S
Molecular Weight217.25 g/mol
Exact Mass217.05
IUPAC NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C7H11N3O3S/c1-2-14(11,12)10-7-9-8-6(13-7)5-3-4-5/h5H,2-4H2,1H3,(H,9,10)
InChIKeyXBSJEPKFFNQNCB-UHFFFAOYSA-N
XLogP0.71
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.25
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide (CID 64587060) is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide is CCS(=O)(=O)Nc1nnc(C2CC2)o1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide?
The InChIKey is XBSJEPKFFNQNCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3S/c1-2-14(11,12)10-7-9-8-6(13-7)5-3-4-5/h5H,2-4H2,1H3,(H,9,10).
What are the key properties of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide?
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide has a molecular weight of 217.25 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)ethanesulfonamide is sourced from PubChem (CID 64587060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).