[di(propan-2-yl)amino]-hydroxy-oxophosphanium

C6H15NO2P+ — CID 71340640

IUPAC[di(propan-2-yl)amino]-hydroxy-oxophosphanium
SMILESCC(C)N(C(C)C)[P+](=O)O
InChIInChI=1S/C6H14NO2P/c1-5(2)7(6(3)4)10(8)9/h5-6H,1-4H3/p+1
InChIKeyLHDWUKLTOVEKHY-UHFFFAOYSA-O
MW164.16 g/mol
LogP1.75
Rot. Bonds3

About [di(propan-2-yl)amino]-hydroxy-oxophosphanium

[di(propan-2-yl)amino]-hydroxy-oxophosphanium (PubChem CID 71340640) has the molecular formula C6H15NO2P+ and a molecular weight of 164.16 g/mol. Its IUPAC name is [di(propan-2-yl)amino]-hydroxy-oxophosphanium.

Molecular Properties

Compound Name[di(propan-2-yl)amino]-hydroxy-oxophosphanium
PubChem CID71340640
Molecular FormulaC6H15NO2P+
Molecular Weight164.16 g/mol
Exact Mass164.08
IUPAC Name[di(propan-2-yl)amino]-hydroxy-oxophosphanium
SMILESCC(C)N(C(C)C)[P+](=O)O
InChIInChI=1S/C6H14NO2P/c1-5(2)7(6(3)4)10(8)9/h5-6H,1-4H3/p+1
InChIKeyLHDWUKLTOVEKHY-UHFFFAOYSA-O
XLogP1.75
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[di(propan-2-yl)amino]-methoxy-oxophosphanium
CID 14840610
dihydroxy(oxo)phosphanium;N-ethyl-N-propan-2-ylpropan-2-amine
CID 139533112
[di(propan-2-yl)amino]oxy-hydroxy-oxophosphanium
CID 88813225
lithium;dihydroxy(oxo)phosphanium;ethane
CID 161092512
dihydroxy(oxo)phosphanium;2-[methyl(propan-2-yl)amino]ethanol
CID 22160999
dihydroxy(oxo)phosphanium;2-methylbutane
CID 87211582
bis(dihydroxy(oxo)phosphanium);1-(methylamino)ethanol
CID 88831052
bis(hydroxy-methyl-oxophosphanium);methane
CID 22015086
sulfuric acid;tetramethylphosphanium
CID 87132357
2-fluoropropyl-hydroxy-oxophosphanium
CID 86621840
bis(dihydroxy(oxo)phosphanium);sulfuric acid
CID 173056581
tris(dihydroxy(oxo)phosphanium);propane
CID 159543377

Frequently Asked Questions

What is the IUPAC name of [di(propan-2-yl)amino]-hydroxy-oxophosphanium?
The IUPAC name of [di(propan-2-yl)amino]-hydroxy-oxophosphanium (CID 71340640) is [di(propan-2-yl)amino]-hydroxy-oxophosphanium.
What is the SMILES notation for [di(propan-2-yl)amino]-hydroxy-oxophosphanium?
The canonical SMILES for [di(propan-2-yl)amino]-hydroxy-oxophosphanium is CC(C)N(C(C)C)[P+](=O)O.
What is the InChIKey of [di(propan-2-yl)amino]-hydroxy-oxophosphanium?
The InChIKey is LHDWUKLTOVEKHY-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H14NO2P/c1-5(2)7(6(3)4)10(8)9/h5-6H,1-4H3/p+1.
What are the key properties of [di(propan-2-yl)amino]-hydroxy-oxophosphanium?
[di(propan-2-yl)amino]-hydroxy-oxophosphanium has a molecular weight of 164.16 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [di(propan-2-yl)amino]-hydroxy-oxophosphanium is sourced from PubChem (CID 71340640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).