ethane;6-oxa-2-azaspiro[3.5]nonane

C11H25NO — CID 145338521

IUPACethane;6-oxa-2-azaspiro[3.5]nonane
SMILESC1COCC2(C1)CNC2.CC.CC
InChIInChI=1S/C7H13NO.2C2H6/c1-2-7(4-8-5-7)6-9-3-1;2*1-2/h8H,1-6H2;2*1-2H3
InChIKeyDISPPWSIHVFIMS-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.44
Rot. Bonds

About ethane;6-oxa-2-azaspiro[3.5]nonane

ethane;6-oxa-2-azaspiro[3.5]nonane (PubChem CID 145338521) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is ethane;6-oxa-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Nameethane;6-oxa-2-azaspiro[3.5]nonane
PubChem CID145338521
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Nameethane;6-oxa-2-azaspiro[3.5]nonane
SMILESC1COCC2(C1)CNC2.CC.CC
InChIInChI=1S/C7H13NO.2C2H6/c1-2-7(4-8-5-7)6-9-3-1;2*1-2/h8H,1-6H2;2*1-2H3
InChIKeyDISPPWSIHVFIMS-UHFFFAOYSA-N
XLogP2.44
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-oxa-2-azaspiro[3.5]nonane?
The IUPAC name of ethane;6-oxa-2-azaspiro[3.5]nonane (CID 145338521) is ethane;6-oxa-2-azaspiro[3.5]nonane.
What is the SMILES notation for ethane;6-oxa-2-azaspiro[3.5]nonane?
The canonical SMILES for ethane;6-oxa-2-azaspiro[3.5]nonane is C1COCC2(C1)CNC2.CC.CC.
What is the InChIKey of ethane;6-oxa-2-azaspiro[3.5]nonane?
The InChIKey is DISPPWSIHVFIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO.2C2H6/c1-2-7(4-8-5-7)6-9-3-1;2*1-2/h8H,1-6H2;2*1-2H3.
What are the key properties of ethane;6-oxa-2-azaspiro[3.5]nonane?
ethane;6-oxa-2-azaspiro[3.5]nonane has a molecular weight of 187.33 g/mol, XLogP of 2.44, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-oxa-2-azaspiro[3.5]nonane is sourced from PubChem (CID 145338521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).