10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane

C15H30N2O — CID 65178467

IUPAC10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
SMILESCCOCCCN1CC2(CCCC2)NCCC1C
InChIInChI=1S/C15H30N2O/c1-3-18-12-6-11-17-13-15(8-4-5-9-15)16-10-7-14(17)2/h14,16H,3-13H2,1-2H3
InChIKeyXLLOMSHQZBHCSJ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.41
Rot. Bonds5

About 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane

10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane (PubChem CID 65178467) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
PubChem CID65178467
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
SMILESCCOCCCN1CC2(CCCC2)NCCC1C
InChIInChI=1S/C15H30N2O/c1-3-18-12-6-11-17-13-15(8-4-5-9-15)16-10-7-14(17)2/h14,16H,3-13H2,1-2H3
InChIKeyXLLOMSHQZBHCSJ-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane (CID 65178467) is 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane is CCOCCCN1CC2(CCCC2)NCCC1C.
What is the InChIKey of 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
The InChIKey is XLLOMSHQZBHCSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-18-12-6-11-17-13-15(8-4-5-9-15)16-10-7-14(17)2/h14,16H,3-13H2,1-2H3.
What are the key properties of 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane?
10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane has a molecular weight of 254.42 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 65178467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).