6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol

C11H19NO4 — CID 78002867

IUPAC6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol
SMILESOC1COC2C(OC3CCNCC3)COC12
InChIInChI=1S/C11H19NO4/c13-8-5-14-11-9(6-15-10(8)11)16-7-1-3-12-4-2-7/h7-13H,1-6H2
InChIKeyYSLCAIOIBRAMPS-UHFFFAOYSA-N
MW229.28 g/mol
LogP-0.72
Rot. Bonds2

About 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol

6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol (PubChem CID 78002867) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol.

Molecular Properties

Compound Name6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol
PubChem CID78002867
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Name6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol
SMILESOC1COC2C(OC3CCNCC3)COC12
InChIInChI=1S/C11H19NO4/c13-8-5-14-11-9(6-15-10(8)11)16-7-1-3-12-4-2-7/h7-13H,1-6H2
InChIKeyYSLCAIOIBRAMPS-UHFFFAOYSA-N
XLogP-0.72
TPSA59.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol?
The IUPAC name of 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol (CID 78002867) is 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol.
What is the SMILES notation for 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol?
The canonical SMILES for 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol is OC1COC2C(OC3CCNCC3)COC12.
What is the InChIKey of 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol?
The InChIKey is YSLCAIOIBRAMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c13-8-5-14-11-9(6-15-10(8)11)16-7-1-3-12-4-2-7/h7-13H,1-6H2.
What are the key properties of 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol?
6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol has a molecular weight of 229.28 g/mol, XLogP of -0.72, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-4-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-ol is sourced from PubChem (CID 78002867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).