9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane

C12H23NO2 — CID 103968945

IUPAC9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
SMILESCOCC1CNCC2(CCCCC2)CO1
InChIInChI=1S/C12H23NO2/c1-14-8-11-7-13-9-12(10-15-11)5-3-2-4-6-12/h11,13H,2-10H2,1H3
InChIKeyZYEHAKQUAMGJKC-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.57
Rot. Bonds2

About 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane

9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane (PubChem CID 103968945) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane.

Molecular Properties

Compound Name9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
PubChem CID103968945
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
SMILESCOCC1CNCC2(CCCCC2)CO1
InChIInChI=1S/C12H23NO2/c1-14-8-11-7-13-9-12(10-15-11)5-3-2-4-6-12/h11,13H,2-10H2,1H3
InChIKeyZYEHAKQUAMGJKC-UHFFFAOYSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
The IUPAC name of 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane (CID 103968945) is 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane.
What is the SMILES notation for 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
The canonical SMILES for 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane is COCC1CNCC2(CCCCC2)CO1.
What is the InChIKey of 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
The InChIKey is ZYEHAKQUAMGJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-14-8-11-7-13-9-12(10-15-11)5-3-2-4-6-12/h11,13H,2-10H2,1H3.
What are the key properties of 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane has a molecular weight of 213.32 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane is sourced from PubChem (CID 103968945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).