7-ethyl-1-oxa-7-azaspiro[3.4]octane

C8H15NO — CID 121247158

IUPAC7-ethyl-1-oxa-7-azaspiro[3.4]octane
SMILESCCN1CCC2(CCO2)C1
InChIInChI=1S/C8H15NO/c1-2-9-5-3-8(7-9)4-6-10-8/h2-7H2,1H3
InChIKeyWPOMHMCVDKAHJI-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.87
Rot. Bonds1

About 7-ethyl-1-oxa-7-azaspiro[3.4]octane

7-ethyl-1-oxa-7-azaspiro[3.4]octane (PubChem CID 121247158) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 7-ethyl-1-oxa-7-azaspiro[3.4]octane.

Molecular Properties

Compound Name7-ethyl-1-oxa-7-azaspiro[3.4]octane
PubChem CID121247158
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name7-ethyl-1-oxa-7-azaspiro[3.4]octane
SMILESCCN1CCC2(CCO2)C1
InChIInChI=1S/C8H15NO/c1-2-9-5-3-8(7-9)4-6-10-8/h2-7H2,1H3
InChIKeyWPOMHMCVDKAHJI-UHFFFAOYSA-N
XLogP0.87
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-1-oxa-7-azaspiro[3.4]octane?
The IUPAC name of 7-ethyl-1-oxa-7-azaspiro[3.4]octane (CID 121247158) is 7-ethyl-1-oxa-7-azaspiro[3.4]octane.
What is the SMILES notation for 7-ethyl-1-oxa-7-azaspiro[3.4]octane?
The canonical SMILES for 7-ethyl-1-oxa-7-azaspiro[3.4]octane is CCN1CCC2(CCO2)C1.
What is the InChIKey of 7-ethyl-1-oxa-7-azaspiro[3.4]octane?
The InChIKey is WPOMHMCVDKAHJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-9-5-3-8(7-9)4-6-10-8/h2-7H2,1H3.
What are the key properties of 7-ethyl-1-oxa-7-azaspiro[3.4]octane?
7-ethyl-1-oxa-7-azaspiro[3.4]octane has a molecular weight of 141.21 g/mol, XLogP of 0.87, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1-oxa-7-azaspiro[3.4]octane is sourced from PubChem (CID 121247158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).