[2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium

C9H19N3O4P+ — CID 154069470

IUPAC[2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium
SMILESO=[P+](ON1CCOC(CO)C1)N1CCNCC1
InChIInChI=1S/C9H19N3O4P/c13-8-9-7-11(5-6-15-9)16-17(14)12-3-1-10-2-4-12/h9-10,13H,1-8H2/q+1
InChIKeyAISOYNQKXLKFPS-UHFFFAOYSA-N
MW264.24 g/mol
LogP-0.83
Rot. Bonds4

About [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium

[2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium (PubChem CID 154069470) has the molecular formula C9H19N3O4P+ and a molecular weight of 264.24 g/mol. Its IUPAC name is [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium.

Molecular Properties

Compound Name[2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium
PubChem CID154069470
Molecular FormulaC9H19N3O4P+
Molecular Weight264.24 g/mol
Exact Mass264.11
IUPAC Name[2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium
SMILESO=[P+](ON1CCOC(CO)C1)N1CCNCC1
InChIInChI=1S/C9H19N3O4P/c13-8-9-7-11(5-6-15-9)16-17(14)12-3-1-10-2-4-12/h9-10,13H,1-8H2/q+1
InChIKeyAISOYNQKXLKFPS-UHFFFAOYSA-N
XLogP-0.83
TPSA74.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[4-[Amino-[(6-methylmorpholin-2-yl)methoxy]phosphoryl]-6-methylmorpholin-2-yl]methanol
CID 22969304
[2-(Hydroxymethyl)morpholin-4-yl]-piperazin-1-ylphosphinic acid
CID 90387212
CID 123518368
CID 123518368
[2-[2-(Hydroxymethyl)morpholin-4-yl]piperazin-1-yl]oxy-oxophosphanium
CID 177754160
[4-(1-Phosphorosooxypiperazin-2-yl)morpholin-2-yl]methanol
CID 177754161

Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium?
The IUPAC name of [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium (CID 154069470) is [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium.
What is the SMILES notation for [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium?
The canonical SMILES for [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium is O=[P+](ON1CCOC(CO)C1)N1CCNCC1.
What is the InChIKey of [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium?
The InChIKey is AISOYNQKXLKFPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O4P/c13-8-9-7-11(5-6-15-9)16-17(14)12-3-1-10-2-4-12/h9-10,13H,1-8H2/q+1.
What are the key properties of [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium?
[2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium has a molecular weight of 264.24 g/mol, XLogP of -0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)morpholin-4-yl]oxy-oxo-piperazin-1-ylphosphanium is sourced from PubChem (CID 154069470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).