2-aminoethoxyphosphonamidic acid

C2H9N2O3P — CID 139489144

IUPAC2-aminoethoxyphosphonamidic acid
SMILESNCCOP(N)(=O)O
InChIInChI=1S/C2H9N2O3P/c3-1-2-7-8(4,5)6/h1-3H2,(H3,4,5,6)
InChIKeySQOUDXANBUYWDQ-UHFFFAOYSA-N
MW140.08 g/mol
LogP-0.98
Rot. Bonds3

About 2-aminoethoxyphosphonamidic acid

2-aminoethoxyphosphonamidic acid (PubChem CID 139489144) has the molecular formula C2H9N2O3P and a molecular weight of 140.08 g/mol. Its IUPAC name is 2-aminoethoxyphosphonamidic acid.

Molecular Properties

Compound Name2-aminoethoxyphosphonamidic acid
PubChem CID139489144
Molecular FormulaC2H9N2O3P
Molecular Weight140.08 g/mol
Exact Mass140.04
IUPAC Name2-aminoethoxyphosphonamidic acid
SMILESNCCOP(N)(=O)O
InChIInChI=1S/C2H9N2O3P/c3-1-2-7-8(4,5)6/h1-3H2,(H3,4,5,6)
InChIKeySQOUDXANBUYWDQ-UHFFFAOYSA-N
XLogP-0.98
TPSA98.57 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.08
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloroethoxyphosphonamidic acid
CID 154086077
CID 174640608
CID 174640608
4-chlorobutoxyphosphonamidic acid
CID 87844580
2-aminoethyl 2-methoxyethyl hydrogen phosphate
CID 59087649
acetic acid;bis(2-aminoethyl dihydrogen phosphate);copper
CID 139211800
[2-aminoethoxy(hydroxy)phosphoryl] hydroxymethyl hydrogen phosphate
CID 129027526
butoxyphosphonamidic acid;guanidine
CID 175407488
amino bis(2-aminoethyl) phosphate
CID 175047381
ethane-1,2-diamine;methylphosphonic acid
CID 19349473
ethane-1,2-diamine;hydrogen phosphate;platinum(2+)
CID 175317536
2-aminoethoxy(phenyl)phosphinic acid
CID 23257414
2-aminoethyl dihydrogen phosphate;pyrrole-2,5-dione
CID 159685474

Frequently Asked Questions

What is the IUPAC name of 2-aminoethoxyphosphonamidic acid?
The IUPAC name of 2-aminoethoxyphosphonamidic acid (CID 139489144) is 2-aminoethoxyphosphonamidic acid.
What is the SMILES notation for 2-aminoethoxyphosphonamidic acid?
The canonical SMILES for 2-aminoethoxyphosphonamidic acid is NCCOP(N)(=O)O.
What is the InChIKey of 2-aminoethoxyphosphonamidic acid?
The InChIKey is SQOUDXANBUYWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H9N2O3P/c3-1-2-7-8(4,5)6/h1-3H2,(H3,4,5,6).
What are the key properties of 2-aminoethoxyphosphonamidic acid?
2-aminoethoxyphosphonamidic acid has a molecular weight of 140.08 g/mol, XLogP of -0.98, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethoxyphosphonamidic acid is sourced from PubChem (CID 139489144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).