4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine

C13H15N3O5S — CID 53175868

IUPAC4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine
SMILESO=S(=O)(c1cc(-c2nnc(C3CC3)o2)co1)N1CCOCC1
InChIInChI=1S/C13H15N3O5S/c17-22(18,16-3-5-19-6-4-16)11-7-10(8-20-11)13-15-14-12(21-13)9-1-2-9/h7-9H,1-6H2
InChIKeyLKIIUJPJXVJLBH-UHFFFAOYSA-N
MW325.35 g/mol
LogP1.23
Rot. Bonds4

About 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine

4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine (PubChem CID 53175868) has the molecular formula C13H15N3O5S and a molecular weight of 325.35 g/mol. Its IUPAC name is 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine
PubChem CID53175868
Molecular FormulaC13H15N3O5S
Molecular Weight325.35 g/mol
Exact Mass325.07
IUPAC Name4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine
SMILESO=S(=O)(c1cc(-c2nnc(C3CC3)o2)co1)N1CCOCC1
InChIInChI=1S/C13H15N3O5S/c17-22(18,16-3-5-19-6-4-16)11-7-10(8-20-11)13-15-14-12(21-13)9-1-2-9/h7-9H,1-6H2
InChIKeyLKIIUJPJXVJLBH-UHFFFAOYSA-N
XLogP1.23
TPSA98.67 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.35
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine?
The IUPAC name of 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine (CID 53175868) is 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine.
What is the SMILES notation for 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine?
The canonical SMILES for 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine is O=S(=O)(c1cc(-c2nnc(C3CC3)o2)co1)N1CCOCC1.
What is the InChIKey of 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine?
The InChIKey is LKIIUJPJXVJLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O5S/c17-22(18,16-3-5-19-6-4-16)11-7-10(8-20-11)13-15-14-12(21-13)9-1-2-9/h7-9H,1-6H2.
What are the key properties of 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine?
4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine has a molecular weight of 325.35 g/mol, XLogP of 1.23, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-yl]sulfonylmorpholine is sourced from PubChem (CID 53175868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).