1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane

C10H18N2O — CID 134478279

IUPAC1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane
SMILESC1CCN(N2CCC23COC3)CC1
InChIInChI=1S/C10H18N2O/c1-2-5-11(6-3-1)12-7-4-10(12)8-13-9-10/h1-9H2
InChIKeyIDKORBHZMALLLD-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.86
Rot. Bonds1

About 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane

1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane (PubChem CID 134478279) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane.

Molecular Properties

Compound Name1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane
PubChem CID134478279
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane
SMILESC1CCN(N2CCC23COC3)CC1
InChIInChI=1S/C10H18N2O/c1-2-5-11(6-3-1)12-7-4-10(12)8-13-9-10/h1-9H2
InChIKeyIDKORBHZMALLLD-UHFFFAOYSA-N
XLogP0.86
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane?
The IUPAC name of 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane (CID 134478279) is 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane.
What is the SMILES notation for 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane?
The canonical SMILES for 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane is C1CCN(N2CCC23COC3)CC1.
What is the InChIKey of 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane?
The InChIKey is IDKORBHZMALLLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-2-5-11(6-3-1)12-7-4-10(12)8-13-9-10/h1-9H2.
What are the key properties of 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane?
1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane has a molecular weight of 182.27 g/mol, XLogP of 0.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-6-oxa-1-azaspiro[3.3]heptane is sourced from PubChem (CID 134478279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).