6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane

C18H36N2O — CID 64861043

IUPAC6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane
SMILESCCCCOCCN1CC(CC)(CC)NCC12CCCC2
InChIInChI=1S/C18H36N2O/c1-4-7-13-21-14-12-20-16-17(5-2,6-3)19-15-18(20)10-8-9-11-18/h19H,4-16H2,1-3H3
InChIKeyWAQRYPTUGOZPQN-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.58
Rot. Bonds8

About 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane

6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane (PubChem CID 64861043) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane
PubChem CID64861043
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane
SMILESCCCCOCCN1CC(CC)(CC)NCC12CCCC2
InChIInChI=1S/C18H36N2O/c1-4-7-13-21-14-12-20-16-17(5-2,6-3)19-15-18(20)10-8-9-11-18/h19H,4-16H2,1-3H3
InChIKeyWAQRYPTUGOZPQN-UHFFFAOYSA-N
XLogP3.58
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane 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 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane (CID 64861043) is 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane is CCCCOCCN1CC(CC)(CC)NCC12CCCC2.
What is the InChIKey of 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane?
The InChIKey is WAQRYPTUGOZPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-7-13-21-14-12-20-16-17(5-2,6-3)19-15-18(20)10-8-9-11-18/h19H,4-16H2,1-3H3.
What are the key properties of 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane?
6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane has a molecular weight of 296.50 g/mol, XLogP of 3.58, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64861043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).