2-methyl-1-oxa-4-azaspiro[5.5]undecane

C10H19NO — CID 55262469

IUPAC2-methyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCC1CNCC2(CCCCC2)O1
InChIInChI=1S/C10H19NO/c1-9-7-11-8-10(12-9)5-3-2-4-6-10/h9,11H,2-8H2,1H3
InChIKeyPAKWDSYXCRDNJZ-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.70
Rot. Bonds

About 2-methyl-1-oxa-4-azaspiro[5.5]undecane

2-methyl-1-oxa-4-azaspiro[5.5]undecane (PubChem CID 55262469) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-methyl-1-oxa-4-azaspiro[5.5]undecane.

Molecular Properties

Compound Name2-methyl-1-oxa-4-azaspiro[5.5]undecane
PubChem CID55262469
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-methyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCC1CNCC2(CCCCC2)O1
InChIInChI=1S/C10H19NO/c1-9-7-11-8-10(12-9)5-3-2-4-6-10/h9,11H,2-8H2,1H3
InChIKeyPAKWDSYXCRDNJZ-UHFFFAOYSA-N
XLogP1.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-oxa-4-azaspiro[5.5]undecane?
The IUPAC name of 2-methyl-1-oxa-4-azaspiro[5.5]undecane (CID 55262469) is 2-methyl-1-oxa-4-azaspiro[5.5]undecane.
What is the SMILES notation for 2-methyl-1-oxa-4-azaspiro[5.5]undecane?
The canonical SMILES for 2-methyl-1-oxa-4-azaspiro[5.5]undecane is CC1CNCC2(CCCCC2)O1.
What is the InChIKey of 2-methyl-1-oxa-4-azaspiro[5.5]undecane?
The InChIKey is PAKWDSYXCRDNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9-7-11-8-10(12-9)5-3-2-4-6-10/h9,11H,2-8H2,1H3.
What are the key properties of 2-methyl-1-oxa-4-azaspiro[5.5]undecane?
2-methyl-1-oxa-4-azaspiro[5.5]undecane has a molecular weight of 169.27 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-oxa-4-azaspiro[5.5]undecane is sourced from PubChem (CID 55262469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).