6-methyl-1-oxa-7-azaspiro[4.4]nonane

C8H15NO — CID 129125882

IUPAC6-methyl-1-oxa-7-azaspiro[4.4]nonane
SMILESCC1NCCC12CCCO2
InChIInChI=1S/C8H15NO/c1-7-8(4-5-9-7)3-2-6-10-8/h7,9H,2-6H2,1H3
InChIKeyPCHBHBXWEQOKQZ-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.92
Rot. Bonds

About 6-methyl-1-oxa-7-azaspiro[4.4]nonane

6-methyl-1-oxa-7-azaspiro[4.4]nonane (PubChem CID 129125882) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 6-methyl-1-oxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Name6-methyl-1-oxa-7-azaspiro[4.4]nonane
PubChem CID129125882
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name6-methyl-1-oxa-7-azaspiro[4.4]nonane
SMILESCC1NCCC12CCCO2
InChIInChI=1S/C8H15NO/c1-7-8(4-5-9-7)3-2-6-10-8/h7,9H,2-6H2,1H3
InChIKeyPCHBHBXWEQOKQZ-UHFFFAOYSA-N
XLogP0.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-oxa-7-azaspiro[4.4]nonane?
The IUPAC name of 6-methyl-1-oxa-7-azaspiro[4.4]nonane (CID 129125882) is 6-methyl-1-oxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for 6-methyl-1-oxa-7-azaspiro[4.4]nonane?
The canonical SMILES for 6-methyl-1-oxa-7-azaspiro[4.4]nonane is CC1NCCC12CCCO2.
What is the InChIKey of 6-methyl-1-oxa-7-azaspiro[4.4]nonane?
The InChIKey is PCHBHBXWEQOKQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-7-8(4-5-9-7)3-2-6-10-8/h7,9H,2-6H2,1H3.
What are the key properties of 6-methyl-1-oxa-7-azaspiro[4.4]nonane?
6-methyl-1-oxa-7-azaspiro[4.4]nonane has a molecular weight of 141.21 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-oxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 129125882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).