2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol

C14H31NO3 — CID 3796382

IUPAC2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol
SMILESCCCCN(CCCC)CCOCCOCCO
InChIInChI=1S/C14H31NO3/c1-3-5-7-15(8-6-4-2)9-11-17-13-14-18-12-10-16/h16H,3-14H2,1-2H3
InChIKeyDOTWRFMCAAWQII-UHFFFAOYSA-N
MW261.41 g/mol
LogP1.91
Rot. Bonds14

About 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol

2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol (PubChem CID 3796382) has the molecular formula C14H31NO3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol
PubChem CID3796382
Molecular FormulaC14H31NO3
Molecular Weight261.41 g/mol
Exact Mass261.23
IUPAC Name2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol
SMILESCCCCN(CCCC)CCOCCOCCO
InChIInChI=1S/C14H31NO3/c1-3-5-7-15(8-6-4-2)9-11-17-13-14-18-12-10-16/h16H,3-14H2,1-2H3
InChIKeyDOTWRFMCAAWQII-UHFFFAOYSA-N
XLogP1.91
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol 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 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol (CID 3796382) is 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol is CCCCN(CCCC)CCOCCOCCO.
What is the InChIKey of 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol?
The InChIKey is DOTWRFMCAAWQII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO3/c1-3-5-7-15(8-6-4-2)9-11-17-13-14-18-12-10-16/h16H,3-14H2,1-2H3.
What are the key properties of 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol?
2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol has a molecular weight of 261.41 g/mol, XLogP of 1.91, 14 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethanol is sourced from PubChem (CID 3796382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).