4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine

C16H33NO2 — CID 138647821

IUPAC4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine
SMILESCC(C)(C)C(C)(C)CCCOCCN1CCOCC1
InChIInChI=1S/C16H33NO2/c1-15(2,3)16(4,5)7-6-11-18-12-8-17-9-13-19-14-10-17/h6-14H2,1-5H3
InChIKeyLLULYQQEGGJCCT-UHFFFAOYSA-N
MW271.44 g/mol
LogP3.19
Rot. Bonds7

About 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine

4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine (PubChem CID 138647821) has the molecular formula C16H33NO2 and a molecular weight of 271.44 g/mol. Its IUPAC name is 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine
PubChem CID138647821
Molecular FormulaC16H33NO2
Molecular Weight271.44 g/mol
Exact Mass271.25
IUPAC Name4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine
SMILESCC(C)(C)C(C)(C)CCCOCCN1CCOCC1
InChIInChI=1S/C16H33NO2/c1-15(2,3)16(4,5)7-6-11-18-12-8-17-9-13-19-14-10-17/h6-14H2,1-5H3
InChIKeyLLULYQQEGGJCCT-UHFFFAOYSA-N
XLogP3.19
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.44
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[2-(4,4-dimethylpentoxy)ethyl]morpholine;N-methylethanamine
CID 142623125
2-methyl-1-(2-morpholin-4-ylethoxy)propan-2-amine
CID 64537619
4-(2-hexoxyethyl)morpholine
CID 3326674
N-methyl-3-(2-morpholin-4-ylethoxy)propan-1-amine
CID 163400432
4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]morpholine
CID 135134424
ethane;4-(2-propoxyethyl)morpholine
CID 154661305
7-(2-morpholin-4-ylethoxy)heptan-1-ol
CID 123873926
4-(4-ethoxybutyl)morpholine
CID 10726253
4-(2-ethoxyethyl)morpholine;hydrobromide
CID 173067075
13,16-bis[2-(2-methoxyethoxy)ethyl]-1,4,7,10-tetraoxa-13,16-diazacyclooctadecane
CID 14910697
4-[2-(4-methylnonan-4-yloxy)ethyl]morpholine
CID 126510289
2-[2-[2-[16-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]ethoxy]ethoxy]ethanamine
CID 11060427

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine (CID 138647821) is 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine is CC(C)(C)C(C)(C)CCCOCCN1CCOCC1.
What is the InChIKey of 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine?
The InChIKey is LLULYQQEGGJCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO2/c1-15(2,3)16(4,5)7-6-11-18-12-8-17-9-13-19-14-10-17/h6-14H2,1-5H3.
What are the key properties of 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine?
4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine has a molecular weight of 271.44 g/mol, XLogP of 3.19, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4,4,5,5-tetramethylhexoxy)ethyl]morpholine is sourced from PubChem (CID 138647821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).