3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine

C15H29NO2 — CID 65167907

IUPAC3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine
SMILESCCOCCNC1CC(OCC)C12CCCCC2
InChIInChI=1S/C15H29NO2/c1-3-17-11-10-16-13-12-14(18-4-2)15(13)8-6-5-7-9-15/h13-14,16H,3-12H2,1-2H3
InChIKeyAIWDHPKCGXPOAY-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.74
Rot. Bonds7

About 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine

3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine (PubChem CID 65167907) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine.

Molecular Properties

Compound Name3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine
PubChem CID65167907
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine
SMILESCCOCCNC1CC(OCC)C12CCCCC2
InChIInChI=1S/C15H29NO2/c1-3-17-11-10-16-13-12-14(18-4-2)15(13)8-6-5-7-9-15/h13-14,16H,3-12H2,1-2H3
InChIKeyAIWDHPKCGXPOAY-UHFFFAOYSA-N
XLogP2.74
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine?
The IUPAC name of 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine (CID 65167907) is 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine.
What is the SMILES notation for 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine?
The canonical SMILES for 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine is CCOCCNC1CC(OCC)C12CCCCC2.
What is the InChIKey of 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine?
The InChIKey is AIWDHPKCGXPOAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-3-17-11-10-16-13-12-14(18-4-2)15(13)8-6-5-7-9-15/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine?
3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine has a molecular weight of 255.40 g/mol, XLogP of 2.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(2-ethoxyethyl)spiro[3.5]nonan-1-amine is sourced from PubChem (CID 65167907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).