2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol

C11H25NO5 — CID 142386297

IUPAC2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol
SMILESNCCOCCOCCCOCCOCCO
InChIInChI=1S/C11H25NO5/c12-2-6-16-10-8-14-4-1-5-15-9-11-17-7-3-13/h13H,1-12H2
InChIKeyMOVVFKPCIPNTAI-UHFFFAOYSA-N
MW251.32 g/mol
LogP-0.61
Rot. Bonds14

About 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol

2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol (PubChem CID 142386297) has the molecular formula C11H25NO5 and a molecular weight of 251.32 g/mol. Its IUPAC name is 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol
PubChem CID142386297
Molecular FormulaC11H25NO5
Molecular Weight251.32 g/mol
Exact Mass251.17
IUPAC Name2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol
SMILESNCCOCCOCCCOCCOCCO
InChIInChI=1S/C11H25NO5/c12-2-6-16-10-8-14-4-1-5-15-9-11-17-7-3-13/h13H,1-12H2
InChIKeyMOVVFKPCIPNTAI-UHFFFAOYSA-N
XLogP-0.61
TPSA83.17 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.32
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol (CID 142386297) is 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol is NCCOCCOCCCOCCOCCO.
What is the InChIKey of 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol?
The InChIKey is MOVVFKPCIPNTAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO5/c12-2-6-16-10-8-14-4-1-5-15-9-11-17-7-3-13/h13H,1-12H2.
What are the key properties of 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol?
2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol has a molecular weight of 251.32 g/mol, XLogP of -0.61, 14 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-[2-(2-aminoethoxy)ethoxy]propoxy]ethoxy]ethanol is sourced from PubChem (CID 142386297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).