2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol

C15H33NO4 — CID 5146658

IUPAC2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol
SMILESCCCCCCN(C)CCOCCOCCOCCO
InChIInChI=1S/C15H33NO4/c1-3-4-5-6-7-16(2)8-10-18-12-14-20-15-13-19-11-9-17/h17H,3-15H2,1-2H3
InChIKeyBTHORWVWPJSATC-UHFFFAOYSA-N
MW291.43 g/mol
LogP1.54
Rot. Bonds16

About 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 5146658) has the molecular formula C15H33NO4 and a molecular weight of 291.43 g/mol. Its IUPAC name is 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol
PubChem CID5146658
Molecular FormulaC15H33NO4
Molecular Weight291.43 g/mol
Exact Mass291.24
IUPAC Name2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol
SMILESCCCCCCN(C)CCOCCOCCOCCO
InChIInChI=1S/C15H33NO4/c1-3-4-5-6-7-16(2)8-10-18-12-14-20-15-13-19-11-9-17/h17H,3-15H2,1-2H3
InChIKeyBTHORWVWPJSATC-UHFFFAOYSA-N
XLogP1.54
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.43
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]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-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol (CID 5146658) is 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol is CCCCCCN(C)CCOCCOCCOCCO.
What is the InChIKey of 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is BTHORWVWPJSATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO4/c1-3-4-5-6-7-16(2)8-10-18-12-14-20-15-13-19-11-9-17/h17H,3-15H2,1-2H3.
What are the key properties of 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 291.43 g/mol, XLogP of 1.54, 16 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[hexyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 5146658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).