2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole

C11H16N4O — CID 10443455

IUPAC2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole
SMILESc1nnc(N2CCC3(CC4CCN3C4)C2)o1
InChIInChI=1S/C11H16N4O/c1-3-15-6-9(1)5-11(15)2-4-14(7-11)10-13-12-8-16-10/h8-9H,1-7H2
InChIKeySLPRFEZFMUXPTF-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.74
Rot. Bonds1

About 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole

2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole (PubChem CID 10443455) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole
PubChem CID10443455
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole
SMILESc1nnc(N2CCC3(CC4CCN3C4)C2)o1
InChIInChI=1S/C11H16N4O/c1-3-15-6-9(1)5-11(15)2-4-14(7-11)10-13-12-8-16-10/h8-9H,1-7H2
InChIKeySLPRFEZFMUXPTF-UHFFFAOYSA-N
XLogP0.74
TPSA45.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole?
The IUPAC name of 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole (CID 10443455) is 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole is c1nnc(N2CCC3(CC4CCN3C4)C2)o1.
What is the InChIKey of 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole?
The InChIKey is SLPRFEZFMUXPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-15-6-9(1)5-11(15)2-4-14(7-11)10-13-12-8-16-10/h8-9H,1-7H2.
What are the key properties of 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole?
2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole has a molecular weight of 220.28 g/mol, XLogP of 0.74, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-spiro[1-azabicyclo[2.2.1]heptane-2,3'-pyrrolidine]-1'-yl-1,3,4-oxadiazole is sourced from PubChem (CID 10443455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).