6-ethoxy-1-azaspiro[3.3]heptane

C8H15NO — CID 106824536

IUPAC6-ethoxy-1-azaspiro[3.3]heptane
SMILESCCOC1CC2(CCN2)C1
InChIInChI=1S/C8H15NO/c1-2-10-7-5-8(6-7)3-4-9-8/h7,9H,2-6H2,1H3
InChIKeyQLVJDPOERYHIOI-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.92
Rot. Bonds2

About 6-ethoxy-1-azaspiro[3.3]heptane

6-ethoxy-1-azaspiro[3.3]heptane (PubChem CID 106824536) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 6-ethoxy-1-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-ethoxy-1-azaspiro[3.3]heptane
PubChem CID106824536
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name6-ethoxy-1-azaspiro[3.3]heptane
SMILESCCOC1CC2(CCN2)C1
InChIInChI=1S/C8H15NO/c1-2-10-7-5-8(6-7)3-4-9-8/h7,9H,2-6H2,1H3
InChIKeyQLVJDPOERYHIOI-UHFFFAOYSA-N
XLogP0.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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-ethoxy-1-azaspiro[3.3]heptane?
The IUPAC name of 6-ethoxy-1-azaspiro[3.3]heptane (CID 106824536) is 6-ethoxy-1-azaspiro[3.3]heptane.
What is the SMILES notation for 6-ethoxy-1-azaspiro[3.3]heptane?
The canonical SMILES for 6-ethoxy-1-azaspiro[3.3]heptane is CCOC1CC2(CCN2)C1.
What is the InChIKey of 6-ethoxy-1-azaspiro[3.3]heptane?
The InChIKey is QLVJDPOERYHIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-10-7-5-8(6-7)3-4-9-8/h7,9H,2-6H2,1H3.
What are the key properties of 6-ethoxy-1-azaspiro[3.3]heptane?
6-ethoxy-1-azaspiro[3.3]heptane has a molecular weight of 141.21 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1-azaspiro[3.3]heptane is sourced from PubChem (CID 106824536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).