bis(2-aminopentoxy)-oxophosphanium

C10H24N2O3P+ — CID 88666943

IUPACbis(2-aminopentoxy)-oxophosphanium
SMILESCCCC(N)CO[P+](=O)OCC(N)CCC
InChIInChI=1S/C10H24N2O3P/c1-3-5-9(11)7-14-16(13)15-8-10(12)6-4-2/h9-10H,3-8,11-12H2,1-2H3/q+1
InChIKeyDTQORFDLRWFXLJ-UHFFFAOYSA-N
MW251.29 g/mol
LogP1.93
Rot. Bonds10

About bis(2-aminopentoxy)-oxophosphanium

bis(2-aminopentoxy)-oxophosphanium (PubChem CID 88666943) has the molecular formula C10H24N2O3P+ and a molecular weight of 251.29 g/mol. Its IUPAC name is bis(2-aminopentoxy)-oxophosphanium.

Molecular Properties

Compound Namebis(2-aminopentoxy)-oxophosphanium
PubChem CID88666943
Molecular FormulaC10H24N2O3P+
Molecular Weight251.29 g/mol
Exact Mass251.15
IUPAC Namebis(2-aminopentoxy)-oxophosphanium
SMILESCCCC(N)CO[P+](=O)OCC(N)CCC
InChIInChI=1S/C10H24N2O3P/c1-3-5-9(11)7-14-16(13)15-8-10(12)6-4-2/h9-10H,3-8,11-12H2,1-2H3/q+1
InChIKeyDTQORFDLRWFXLJ-UHFFFAOYSA-N
XLogP1.93
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-aminopentoxy)-oxophosphanium?
The IUPAC name of bis(2-aminopentoxy)-oxophosphanium (CID 88666943) is bis(2-aminopentoxy)-oxophosphanium.
What is the SMILES notation for bis(2-aminopentoxy)-oxophosphanium?
The canonical SMILES for bis(2-aminopentoxy)-oxophosphanium is CCCC(N)CO[P+](=O)OCC(N)CCC.
What is the InChIKey of bis(2-aminopentoxy)-oxophosphanium?
The InChIKey is DTQORFDLRWFXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3P/c1-3-5-9(11)7-14-16(13)15-8-10(12)6-4-2/h9-10H,3-8,11-12H2,1-2H3/q+1.
What are the key properties of bis(2-aminopentoxy)-oxophosphanium?
bis(2-aminopentoxy)-oxophosphanium has a molecular weight of 251.29 g/mol, XLogP of 1.93, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-aminopentoxy)-oxophosphanium is sourced from PubChem (CID 88666943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).