6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane

C10H18N2O — CID 129030568

IUPAC6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane
SMILESC1CC(N2CC3(COC3)C2)CCN1
InChIInChI=1S/C10H18N2O/c1-3-11-4-2-9(1)12-5-10(6-12)7-13-8-10/h9,11H,1-8H2
InChIKeyJGLPBXUDAPGOJK-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.07
Rot. Bonds1

About 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane

6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane (PubChem CID 129030568) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane
PubChem CID129030568
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane
SMILESC1CC(N2CC3(COC3)C2)CCN1
InChIInChI=1S/C10H18N2O/c1-3-11-4-2-9(1)12-5-10(6-12)7-13-8-10/h9,11H,1-8H2
InChIKeyJGLPBXUDAPGOJK-UHFFFAOYSA-N
XLogP0.07
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane?
The IUPAC name of 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane (CID 129030568) is 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane.
What is the SMILES notation for 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane?
The canonical SMILES for 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane is C1CC(N2CC3(COC3)C2)CCN1.
What is the InChIKey of 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane?
The InChIKey is JGLPBXUDAPGOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-11-4-2-9(1)12-5-10(6-12)7-13-8-10/h9,11H,1-8H2.
What are the key properties of 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane?
6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane has a molecular weight of 182.27 g/mol, XLogP of 0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-4-yl-2-oxa-6-azaspiro[3.3]heptane is sourced from PubChem (CID 129030568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).