2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride

C5H14FNO4 — CID 173050654

IUPAC2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride
SMILESCN(OCCO)OCCO.F
InChIInChI=1S/C5H13NO4.FH/c1-6(9-4-2-7)10-5-3-8;/h7-8H,2-5H2,1H3;1H
InChIKeyJWXNCYRCMRIILC-UHFFFAOYSA-N
MW171.17 g/mol
LogP-1.08
Rot. Bonds6

About 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride

2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride (PubChem CID 173050654) has the molecular formula C5H14FNO4 and a molecular weight of 171.17 g/mol. Its IUPAC name is 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride.

Molecular Properties

Compound Name2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride
PubChem CID173050654
Molecular FormulaC5H14FNO4
Molecular Weight171.17 g/mol
Exact Mass171.09
IUPAC Name2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride
SMILESCN(OCCO)OCCO.F
InChIInChI=1S/C5H13NO4.FH/c1-6(9-4-2-7)10-5-3-8;/h7-8H,2-5H2,1H3;1H
InChIKeyJWXNCYRCMRIILC-UHFFFAOYSA-N
XLogP-1.08
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 5-1.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[ethyl(2-hydroxyethoxy)amino]oxyethanol;2-[2-hydroxyethoxy(methyl)amino]oxyethanol
CID 87918272
2-[2-hydroxyethoxy(methyl)amino]oxyethanol;methanesulfonic acid
CID 175015105
2-[2-hydroxyethoxy(methyl)amino]oxyethanol;prop-2-enamide
CID 174799065
2-[ethyl(2-hydroxyethoxy)amino]oxyethanol
CID 18004331
2-(diaminoamino)oxyethanol
CID 89334158
2-[fluoro(2-hydroxyethoxy)amino]oxyethanol
CID 175332230
2-(dipropylamino)oxyethanol
CID 87103573
2-[2-hydroxyethoxy(methoxymethyl)amino]oxyethanol
CID 87906536
CID 173190602
CID 173190602
2-[bis(2-hydroxyethoxy)amino]oxyethanol;carbonic acid
CID 87903957
benzene;2-[chloro(2-hydroxyethoxy)amino]oxyethanol
CID 174400425
2-[2-(dimethylamino)ethoxy]ethanol
CID 158737336

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride?
The IUPAC name of 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride (CID 173050654) is 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride.
What is the SMILES notation for 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride?
The canonical SMILES for 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride is CN(OCCO)OCCO.F.
What is the InChIKey of 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride?
The InChIKey is JWXNCYRCMRIILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO4.FH/c1-6(9-4-2-7)10-5-3-8;/h7-8H,2-5H2,1H3;1H.
What are the key properties of 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride?
2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride has a molecular weight of 171.17 g/mol, XLogP of -1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethoxy(methyl)amino]oxyethanol;hydrofluoride is sourced from PubChem (CID 173050654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).