2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane

C12H24N2O2 — CID 82038602

IUPAC2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane
SMILESCOCCOCCN1CCC2(CCNC2)C1
InChIInChI=1S/C12H24N2O2/c1-15-8-9-16-7-6-14-5-3-12(11-14)2-4-13-10-12/h13H,2-11H2,1H3
InChIKeyMFOHLLINMWKQEQ-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.33
Rot. Bonds6

About 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane

2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane (PubChem CID 82038602) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane
PubChem CID82038602
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane
SMILESCOCCOCCN1CCC2(CCNC2)C1
InChIInChI=1S/C12H24N2O2/c1-15-8-9-16-7-6-14-5-3-12(11-14)2-4-13-10-12/h13H,2-11H2,1H3
InChIKeyMFOHLLINMWKQEQ-UHFFFAOYSA-N
XLogP0.33
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane (CID 82038602) is 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane is COCCOCCN1CCC2(CCNC2)C1.
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane?
The InChIKey is MFOHLLINMWKQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-15-8-9-16-7-6-14-5-3-12(11-14)2-4-13-10-12/h13H,2-11H2,1H3.
What are the key properties of 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane?
2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane has a molecular weight of 228.34 g/mol, XLogP of 0.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethyl]-2,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 82038602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).