2-methoxyspiro[3.5]nonane

C10H18O — CID 162724743

IUPAC2-methoxyspiro[3.5]nonane
SMILESCOC1CC2(CCCCC2)C1
InChIInChI=1S/C10H18O/c1-11-9-7-10(8-9)5-3-2-4-6-10/h9H,2-8H2,1H3
InChIKeyHSYDAWIONNLART-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.75
Rot. Bonds1

About 2-methoxyspiro[3.5]nonane

2-methoxyspiro[3.5]nonane (PubChem CID 162724743) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2-methoxyspiro[3.5]nonane.

Molecular Properties

Compound Name2-methoxyspiro[3.5]nonane
PubChem CID162724743
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2-methoxyspiro[3.5]nonane
SMILESCOC1CC2(CCCCC2)C1
InChIInChI=1S/C10H18O/c1-11-9-7-10(8-9)5-3-2-4-6-10/h9H,2-8H2,1H3
InChIKeyHSYDAWIONNLART-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyspiro[3.5]nonane?
The IUPAC name of 2-methoxyspiro[3.5]nonane (CID 162724743) is 2-methoxyspiro[3.5]nonane.
What is the SMILES notation for 2-methoxyspiro[3.5]nonane?
The canonical SMILES for 2-methoxyspiro[3.5]nonane is COC1CC2(CCCCC2)C1.
What is the InChIKey of 2-methoxyspiro[3.5]nonane?
The InChIKey is HSYDAWIONNLART-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-11-9-7-10(8-9)5-3-2-4-6-10/h9H,2-8H2,1H3.
What are the key properties of 2-methoxyspiro[3.5]nonane?
2-methoxyspiro[3.5]nonane has a molecular weight of 154.25 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyspiro[3.5]nonane is sourced from PubChem (CID 162724743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).