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

C6H9N3O3S — CID 64587061

IUPACN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C6H9N3O3S/c1-13(10,11)9-6-8-7-5(12-6)4-2-3-4/h4H,2-3H2,1H3,(H,8,9)
InChIKeyKOFABSJTLOLZEW-UHFFFAOYSA-N
MW203.22 g/mol
LogP0.32
Rot. Bonds3

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

N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide (PubChem CID 64587061) has the molecular formula C6H9N3O3S and a molecular weight of 203.22 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide
PubChem CID64587061
Molecular FormulaC6H9N3O3S
Molecular Weight203.22 g/mol
Exact Mass203.04
IUPAC NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1nnc(C2CC2)o1
InChIInChI=1S/C6H9N3O3S/c1-13(10,11)9-6-8-7-5(12-6)4-2-3-4/h4H,2-3H2,1H3,(H,8,9)
InChIKeyKOFABSJTLOLZEW-UHFFFAOYSA-N
XLogP0.32
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.22
LogP ≤ 50.32
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)methanesulfonamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide (CID 64587061) is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide is CS(=O)(=O)Nc1nnc(C2CC2)o1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide?
The InChIKey is KOFABSJTLOLZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O3S/c1-13(10,11)9-6-8-7-5(12-6)4-2-3-4/h4H,2-3H2,1H3,(H,8,9).
What are the key properties of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide?
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methanesulfonamide has a molecular weight of 203.22 g/mol, XLogP of 0.32, 3 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)methanesulfonamide is sourced from PubChem (CID 64587061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).