3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane

C16H32N2O2 — CID 64842964

IUPAC3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
SMILESCCC1CN(CCOCCOC)C2(CCCCC2)CN1
InChIInChI=1S/C16H32N2O2/c1-3-15-13-18(9-10-20-12-11-19-2)16(14-17-15)7-5-4-6-8-16/h15,17H,3-14H2,1-2H3
InChIKeyOEXJXVUTYACTIX-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.04
Rot. Bonds7

About 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane

3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane (PubChem CID 64842964) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
PubChem CID64842964
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
SMILESCCC1CN(CCOCCOC)C2(CCCCC2)CN1
InChIInChI=1S/C16H32N2O2/c1-3-15-13-18(9-10-20-12-11-19-2)16(14-17-15)7-5-4-6-8-16/h15,17H,3-14H2,1-2H3
InChIKeyOEXJXVUTYACTIX-UHFFFAOYSA-N
XLogP2.04
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.04
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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Related Compounds

(1-(Morpholin-4-yl)cyclohexyl)methanamine
CID 3157486
1-(Morpholin-4-ylmethyl)cyclohexanamine
CID 6484225
(4-Ethylcyclohexyl)[2-(4-morpholinyl)ethyl]amine
CID 782064
4-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 784225
3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 2846685
N-[(1-morpholin-4-ylcyclohexyl)methyl]cycloheptanamine
CID 75401952
2-[methyl-[(2S)-2-[(1-piperidin-1-ylcyclohexyl)methylamino]propyl]amino]ethanol
CID 171359740
(1R,2S)-1-cyclohexyl-2-morpholin-4-ylpropan-1-amine
CID 134966237
3-Ethyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64841022
3-Methyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64846529
3-Ethyl-4-[2-(2,2,2-trifluoroethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64876650
3-Methyl-4-[2-(2,2,2-trifluoroethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64877220

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane (CID 64842964) is 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane is CCC1CN(CCOCCOC)C2(CCCCC2)CN1.
What is the InChIKey of 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane?
The InChIKey is OEXJXVUTYACTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-3-15-13-18(9-10-20-12-11-19-2)16(14-17-15)7-5-4-6-8-16/h15,17H,3-14H2,1-2H3.
What are the key properties of 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane?
3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane has a molecular weight of 284.44 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 64842964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).