2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol

C6H15NO5 — CID 87906536

IUPAC2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol
SMILESCOCN(OCCO)OCCO
InChIInChI=1S/C6H15NO5/c1-10-6-7(11-4-2-8)12-5-3-9/h8-9H,2-6H2,1H3
InChIKeyDFKALCVBQVBSII-UHFFFAOYSA-N
MW181.19 g/mol
LogP-1.26
Rot. Bonds8

About 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol

2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol (PubChem CID 87906536) has the molecular formula C6H15NO5 and a molecular weight of 181.19 g/mol. Its IUPAC name is 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol.

Molecular Properties

Compound Name2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol
PubChem CID87906536
Molecular FormulaC6H15NO5
Molecular Weight181.19 g/mol
Exact Mass181.10
IUPAC Name2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol
SMILESCOCN(OCCO)OCCO
InChIInChI=1S/C6H15NO5/c1-10-6-7(11-4-2-8)12-5-3-9/h8-9H,2-6H2,1H3
InChIKeyDFKALCVBQVBSII-UHFFFAOYSA-N
XLogP-1.26
TPSA71.39 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 5-1.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[ethyl(2-hydroxyethoxy)amino]oxyethanol
CID 18004331
2-[ethyl(2-hydroxyethoxy)amino]oxyethanol;2-[2-hydroxyethoxy(methyl)amino]oxyethanol
CID 87918272
sodium 2-methoxyethanol
CID 21124383
2-methoxyethanol;sulfane
CID 174965249
bismuthane;2-methoxyethanol
CID 174782924
ethane;2-methoxyethanol
CID 175109361
2-[2-[bis(2-hydroxyethoxy)amino]ethoxy]ethanol
CID 87524691
2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride
CID 173050654
2-[2-methoxyethoxy(propan-2-yl)amino]oxyethanol
CID 150143139
2-[2-hydroxyethoxy(nonadecyl)amino]oxyethanol
CID 87327457
1,2-dimethoxyethane;ethane-1,2-diol;tris(2-methoxyethanol)
CID 160893759
2-[2-hydroxyethoxy(prop-2-enyl)amino]oxyethanol;hydrochloride
CID 174430293

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol?
The IUPAC name of 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol (CID 87906536) is 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol.
What is the SMILES notation for 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol?
The canonical SMILES for 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol is COCN(OCCO)OCCO.
What is the InChIKey of 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol?
The InChIKey is DFKALCVBQVBSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO5/c1-10-6-7(11-4-2-8)12-5-3-9/h8-9H,2-6H2,1H3.
What are the key properties of 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol?
2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol has a molecular weight of 181.19 g/mol, XLogP of -1.26, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol is sourced from PubChem (CID 87906536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).