ethylamino-hydroxy-oxophosphanium

C2H7NO2P+ — CID 173156708

IUPACethylamino-hydroxy-oxophosphanium
SMILESCCN[P+](=O)O
InChIInChI=1S/C2H6NO2P/c1-2-3-6(4)5/h2H2,1H3,(H-,3,4,5)/p+1
InChIKeyTYIJUKHJMOAQKF-UHFFFAOYSA-O
MW108.06 g/mol
LogP0.25
Rot. Bonds2

About ethylamino-hydroxy-oxophosphanium

ethylamino-hydroxy-oxophosphanium (PubChem CID 173156708) has the molecular formula C2H7NO2P+ and a molecular weight of 108.06 g/mol. Its IUPAC name is ethylamino-hydroxy-oxophosphanium.

Molecular Properties

Compound Nameethylamino-hydroxy-oxophosphanium
PubChem CID173156708
Molecular FormulaC2H7NO2P+
Molecular Weight108.06 g/mol
Exact Mass108.02
IUPAC Nameethylamino-hydroxy-oxophosphanium
SMILESCCN[P+](=O)O
InChIInChI=1S/C2H6NO2P/c1-2-3-6(4)5/h2H2,1H3,(H-,3,4,5)/p+1
InChIKeyTYIJUKHJMOAQKF-UHFFFAOYSA-O
XLogP0.25
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.06
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethylamino-hydroxy-oxophosphanium?
The IUPAC name of ethylamino-hydroxy-oxophosphanium (CID 173156708) is ethylamino-hydroxy-oxophosphanium.
What is the SMILES notation for ethylamino-hydroxy-oxophosphanium?
The canonical SMILES for ethylamino-hydroxy-oxophosphanium is CCN[P+](=O)O.
What is the InChIKey of ethylamino-hydroxy-oxophosphanium?
The InChIKey is TYIJUKHJMOAQKF-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H6NO2P/c1-2-3-6(4)5/h2H2,1H3,(H-,3,4,5)/p+1.
What are the key properties of ethylamino-hydroxy-oxophosphanium?
ethylamino-hydroxy-oxophosphanium has a molecular weight of 108.06 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethylamino-hydroxy-oxophosphanium is sourced from PubChem (CID 173156708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).