bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium

C8H16N2O7P+ — CID 175137539

IUPACbis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium
SMILESO=C(CO[P+](=O)OCC(=O)NCCO)NCCO
InChIInChI=1S/C8H15N2O7P/c11-3-1-9-7(13)5-16-18(15)17-6-8(14)10-2-4-12/h11-12H,1-6H2,(H-,9,10,13,14)/p+1
InChIKeyCHIGIDKMBUATHE-UHFFFAOYSA-O
MW283.20 g/mol
LogP-2.11
Rot. Bonds10

About bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium

bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium (PubChem CID 175137539) has the molecular formula C8H16N2O7P+ and a molecular weight of 283.20 g/mol. Its IUPAC name is bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium.

Molecular Properties

Compound Namebis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium
PubChem CID175137539
Molecular FormulaC8H16N2O7P+
Molecular Weight283.20 g/mol
Exact Mass283.07
IUPAC Namebis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium
SMILESO=C(CO[P+](=O)OCC(=O)NCCO)NCCO
InChIInChI=1S/C8H15N2O7P/c11-3-1-9-7(13)5-16-18(15)17-6-8(14)10-2-4-12/h11-12H,1-6H2,(H-,9,10,13,14)/p+1
InChIKeyCHIGIDKMBUATHE-UHFFFAOYSA-O
XLogP-2.11
TPSA134.19 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 5-2.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

[2-[2-[2-(2-hydroxyethylamino)-2-oxoethoxy]ethoxy]acetyl]azanide;yttrium
CID 155596009
N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide
CID 155596113
N-(2-hydroxyethyl)-2-sulfanylacetamide
CID 14480079
ethyl 3-(2-hydroxyethylamino)-3-oxopropanoate
CID 15937007
2-[2-(2-hydrazinylethoxy)ethoxy]-N-(2-hydroxyethyl)acetamide
CID 123205236
N-(2-hydroxyethyl)-3-[[3-(2-hydroxyethylamino)-3-oxopropyl]amino]propanamide
CID 86062914
2-(2-butoxyethoxy)-N-(2-hydroxyethyl)acetamide
CID 89471630
N-(2-hydroxyethyl)-N'-(2-sulfanylethyl)propanediamide
CID 19607288
N-(2-hydroxyethyl)-2-(2-tridecoxyethoxy)acetamide
CID 100965697
N-(2-hydroxyethyl)-2-(2,4,6-tribromophenoxy)acetamide
CID 43509908
N-(2-hydroxyethyl)-2-[4-[(E)-2-[4-[2-(2-hydroxyethylamino)-2-oxoethoxy]phenyl]ethenyl]phenoxy]acetamide
CID 134394160
3-amino-N-(2-hydroxyethyl)-3-sulfanylidenepropanamide
CID 65416830

Frequently Asked Questions

What is the IUPAC name of bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium?
The IUPAC name of bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium (CID 175137539) is bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium.
What is the SMILES notation for bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium?
The canonical SMILES for bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium is O=C(CO[P+](=O)OCC(=O)NCCO)NCCO.
What is the InChIKey of bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium?
The InChIKey is CHIGIDKMBUATHE-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H15N2O7P/c11-3-1-9-7(13)5-16-18(15)17-6-8(14)10-2-4-12/h11-12H,1-6H2,(H-,9,10,13,14)/p+1.
What are the key properties of bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium?
bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium has a molecular weight of 283.20 g/mol, XLogP of -2.11, 10 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-(2-hydroxyethylamino)-2-oxoethoxy]-oxophosphanium is sourced from PubChem (CID 175137539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).