2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole

C11H17N3O2 — CID 119031516

IUPAC2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole
SMILESC1CCC(c2nnc([C@H]3CCCO3)o2)NC1
InChIInChI=1S/C11H17N3O2/c1-2-6-12-8(4-1)10-13-14-11(16-10)9-5-3-7-15-9/h8-9,12H,1-7H2/t8?,9-/m1/s1
InChIKeyGVFMFDQGJIRVRD-YGPZHTELSA-N
MW223.28 g/mol
LogP1.74
Rot. Bonds2

About 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole

2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole (PubChem CID 119031516) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole
PubChem CID119031516
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole
SMILESC1CCC(c2nnc([C@H]3CCCO3)o2)NC1
InChIInChI=1S/C11H17N3O2/c1-2-6-12-8(4-1)10-13-14-11(16-10)9-5-3-7-15-9/h8-9,12H,1-7H2/t8?,9-/m1/s1
InChIKeyGVFMFDQGJIRVRD-YGPZHTELSA-N
XLogP1.74
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole?
The IUPAC name of 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole (CID 119031516) is 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole is C1CCC(c2nnc([C@H]3CCCO3)o2)NC1.
What is the InChIKey of 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole?
The InChIKey is GVFMFDQGJIRVRD-YGPZHTELSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-2-6-12-8(4-1)10-13-14-11(16-10)9-5-3-7-15-9/h8-9,12H,1-7H2/t8?,9-/m1/s1.
What are the key properties of 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole?
2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole has a molecular weight of 223.28 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-oxolan-2-yl]-5-piperidin-2-yl-1,3,4-oxadiazole is sourced from PubChem (CID 119031516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).