2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate

C8H20NO6P — CID 147848914

IUPAC2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate
SMILESCOP(=O)(OC)OCCOCCOCCN
InChIInChI=1S/C8H20NO6P/c1-11-16(10,12-2)15-8-7-14-6-5-13-4-3-9/h3-9H2,1-2H3
InChIKeyHULAXIHHYZCODN-UHFFFAOYSA-N
MW257.22 g/mol
LogP0.40
Rot. Bonds11

About 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate

2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate (PubChem CID 147848914) has the molecular formula C8H20NO6P and a molecular weight of 257.22 g/mol. Its IUPAC name is 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate.

Molecular Properties

Compound Name2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate
PubChem CID147848914
Molecular FormulaC8H20NO6P
Molecular Weight257.22 g/mol
Exact Mass257.10
IUPAC Name2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate
SMILESCOP(=O)(OC)OCCOCCOCCN
InChIInChI=1S/C8H20NO6P/c1-11-16(10,12-2)15-8-7-14-6-5-13-4-3-9/h3-9H2,1-2H3
InChIKeyHULAXIHHYZCODN-UHFFFAOYSA-N
XLogP0.40
TPSA89.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.22
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-methoxyethoxy)ethoxy]ethyl dimethyl phosphate
CID 140898366
2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl methyl hydrogen phosphate
CID 129040767
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 18764651
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;hydrochloride
CID 146502612
methanamine;2-(2-methoxyethoxy)ethanamine
CID 145171254
bis[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]phosphoryl bis[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl] phosphate
CID 101216646
2-(dimethylamino)ethyl 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl phosphate
CID 121405453
2-[2-[3-[2-(2-methoxyethoxy)ethoxy]propoxy]ethoxy]ethanamine
CID 146320426
2-[2-[3-(2-methoxyethoxy)propoxy]ethoxy]ethanamine
CID 103482612
2-[2-(3-methoxypropoxy)ethoxy]ethanamine
CID 103175799
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
1,3-diacetamidopropan-2-yl 2-(2-dimethoxyphosphoryloxyethoxy)ethyl methyl phosphate
CID 23399697

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate?
The IUPAC name of 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate (CID 147848914) is 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate.
What is the SMILES notation for 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate?
The canonical SMILES for 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate is COP(=O)(OC)OCCOCCOCCN.
What is the InChIKey of 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate?
The InChIKey is HULAXIHHYZCODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20NO6P/c1-11-16(10,12-2)15-8-7-14-6-5-13-4-3-9/h3-9H2,1-2H3.
What are the key properties of 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate?
2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate has a molecular weight of 257.22 g/mol, XLogP of 0.40, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethoxy)ethoxy]ethyl dimethyl phosphate is sourced from PubChem (CID 147848914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).