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

C10H21NO — CID 145305511

IUPACethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane
SMILESCC.CC1NCCC12CCCO2
InChIInChI=1S/C8H15NO.C2H6/c1-7-8(4-5-9-7)3-2-6-10-8;1-2/h7,9H,2-6H2,1H3;1-2H3
InChIKeyGSKOTKOEKYCOOA-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.94
Rot. Bonds

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

ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane (PubChem CID 145305511) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Nameethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane
PubChem CID145305511
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nameethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane
SMILESCC.CC1NCCC12CCCO2
InChIInChI=1S/C8H15NO.C2H6/c1-7-8(4-5-9-7)3-2-6-10-8;1-2/h7,9H,2-6H2,1H3;1-2H3
InChIKeyGSKOTKOEKYCOOA-UHFFFAOYSA-N
XLogP1.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane?
The IUPAC name of ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane (CID 145305511) is ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane?
The canonical SMILES for ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane is CC.CC1NCCC12CCCO2.
What is the InChIKey of ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane?
The InChIKey is GSKOTKOEKYCOOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.C2H6/c1-7-8(4-5-9-7)3-2-6-10-8;1-2/h7,9H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane?
ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane has a molecular weight of 171.28 g/mol, XLogP of 1.94, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-1-oxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 145305511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).