9-methoxy-3-azaspiro[5.5]undecane

C11H21NO — CID 58101855

IUPAC9-methoxy-3-azaspiro[5.5]undecane
SMILESCOC1CCC2(CCNCC2)CC1
InChIInChI=1S/C11H21NO/c1-13-10-2-4-11(5-3-10)6-8-12-9-7-11/h10,12H,2-9H2,1H3
InChIKeyMRZGBWPEZYBPFV-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.95
Rot. Bonds1

About 9-methoxy-3-azaspiro[5.5]undecane

9-methoxy-3-azaspiro[5.5]undecane (PubChem CID 58101855) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 9-methoxy-3-azaspiro[5.5]undecane.

Molecular Properties

Compound Name9-methoxy-3-azaspiro[5.5]undecane
PubChem CID58101855
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name9-methoxy-3-azaspiro[5.5]undecane
SMILESCOC1CCC2(CCNCC2)CC1
InChIInChI=1S/C11H21NO/c1-13-10-2-4-11(5-3-10)6-8-12-9-7-11/h10,12H,2-9H2,1H3
InChIKeyMRZGBWPEZYBPFV-UHFFFAOYSA-N
XLogP1.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methoxy-3-azaspiro[5.5]undecane?
The IUPAC name of 9-methoxy-3-azaspiro[5.5]undecane (CID 58101855) is 9-methoxy-3-azaspiro[5.5]undecane.
What is the SMILES notation for 9-methoxy-3-azaspiro[5.5]undecane?
The canonical SMILES for 9-methoxy-3-azaspiro[5.5]undecane is COC1CCC2(CCNCC2)CC1.
What is the InChIKey of 9-methoxy-3-azaspiro[5.5]undecane?
The InChIKey is MRZGBWPEZYBPFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-13-10-2-4-11(5-3-10)6-8-12-9-7-11/h10,12H,2-9H2,1H3.
What are the key properties of 9-methoxy-3-azaspiro[5.5]undecane?
9-methoxy-3-azaspiro[5.5]undecane has a molecular weight of 183.29 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methoxy-3-azaspiro[5.5]undecane is sourced from PubChem (CID 58101855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).