2-aminoethoxy(trihydroxy)phosphanium

C2H9NO4P+ — CID 55290252

IUPAC2-aminoethoxy(trihydroxy)phosphanium
SMILESNCCO[P+](O)(O)O
InChIInChI=1S/C2H9NO4P/c3-1-2-7-8(4,5)6/h4-6H,1-3H2/q+1
InChIKeyJXCKJQNVTSPCDS-UHFFFAOYSA-N
MW142.07 g/mol
LogP-1.38
Rot. Bonds3

About 2-aminoethoxy(trihydroxy)phosphanium

2-aminoethoxy(trihydroxy)phosphanium (PubChem CID 55290252) has the molecular formula C2H9NO4P+ and a molecular weight of 142.07 g/mol. Its IUPAC name is 2-aminoethoxy(trihydroxy)phosphanium.

Molecular Properties

Compound Name2-aminoethoxy(trihydroxy)phosphanium
PubChem CID55290252
Molecular FormulaC2H9NO4P+
Molecular Weight142.07 g/mol
Exact Mass142.03
IUPAC Name2-aminoethoxy(trihydroxy)phosphanium
SMILESNCCO[P+](O)(O)O
InChIInChI=1S/C2H9NO4P/c3-1-2-7-8(4,5)6/h4-6H,1-3H2/q+1
InChIKeyJXCKJQNVTSPCDS-UHFFFAOYSA-N
XLogP-1.38
TPSA95.94 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.07
LogP ≤ 5-1.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-1-(2-aminoethoxy)ethanol
CID 22372816
1-(2-aminoethoxy)ethanol;hydroxylamine
CID 87972798
1-(2-aminoethoxy)propan-1-ol
CID 87147915
2-aminoethoxy(ethoxy)methanol
CID 155706478
1-(2-aminoethoxy)-2,2-dimethylpropan-1-ol
CID 123688713
1-(2-aminoethoxy)ethanol;1-ethoxyethanol
CID 157343406
4-(2-aminoethoxy)pentan-2-ol
CID 173098597
2-propan-2-yloxyethanamine
CID 533866
2-(difluoromethoxy)ethanamine;ethane
CID 176962919
3-[3-(2-aminoethoxy)butan-2-yloxy]propane-1,2-diol
CID 129092165
2-(2-aminoethoxy)-3,3-dimethylbutan-1-ol
CID 175288171
1-(3-aminopropoxy)ethanol
CID 19915425

Frequently Asked Questions

What is the IUPAC name of 2-aminoethoxy(trihydroxy)phosphanium?
The IUPAC name of 2-aminoethoxy(trihydroxy)phosphanium (CID 55290252) is 2-aminoethoxy(trihydroxy)phosphanium.
What is the SMILES notation for 2-aminoethoxy(trihydroxy)phosphanium?
The canonical SMILES for 2-aminoethoxy(trihydroxy)phosphanium is NCCO[P+](O)(O)O.
What is the InChIKey of 2-aminoethoxy(trihydroxy)phosphanium?
The InChIKey is JXCKJQNVTSPCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H9NO4P/c3-1-2-7-8(4,5)6/h4-6H,1-3H2/q+1.
What are the key properties of 2-aminoethoxy(trihydroxy)phosphanium?
2-aminoethoxy(trihydroxy)phosphanium has a molecular weight of 142.07 g/mol, XLogP of -1.38, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethoxy(trihydroxy)phosphanium is sourced from PubChem (CID 55290252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).