hydroxy-oxo-pyridin-4-ylphosphanium

C5H5NO2P+ — CID 150562998

IUPAChydroxy-oxo-pyridin-4-ylphosphanium
SMILESO=[P+](O)c1ccncc1
InChIInChI=1S/C5H4NO2P/c7-9(8)5-1-3-6-4-2-5/h1-4H/p+1
InChIKeyOAVUZDJHFXCSQR-UHFFFAOYSA-O
MW142.07 g/mol
LogP0.44
Rot. Bonds1

About hydroxy-oxo-pyridin-4-ylphosphanium

hydroxy-oxo-pyridin-4-ylphosphanium (PubChem CID 150562998) has the molecular formula C5H5NO2P+ and a molecular weight of 142.07 g/mol. Its IUPAC name is hydroxy-oxo-pyridin-4-ylphosphanium.

Molecular Properties

Compound Namehydroxy-oxo-pyridin-4-ylphosphanium
PubChem CID150562998
Molecular FormulaC5H5NO2P+
Molecular Weight142.07 g/mol
Exact Mass142.01
IUPAC Namehydroxy-oxo-pyridin-4-ylphosphanium
SMILESO=[P+](O)c1ccncc1
InChIInChI=1S/C5H4NO2P/c7-9(8)5-1-3-6-4-2-5/h1-4H/p+1
InChIKeyOAVUZDJHFXCSQR-UHFFFAOYSA-O
XLogP0.44
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.07
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

gold;4-pyridin-4-ylpyridine
CID 159917709
4-nitropyridine;hydrate
CID 132647818
formic acid;4-methylpyridine
CID 162172361
4-methylpyridine;sulfuric acid
CID 71383556
acetic acid;4-(trifluoromethyl)pyridine;hydrobromide
CID 174739301
azane;4-phenylpyridine
CID 175775455
4-chloropyridine;formaldehyde
CID 161076349
(3-chloro-4-methylphenyl)-hydroxy-oxophosphanium
CID 6330252
pyridin-4-ylmethoxymethanethioic S-acid
CID 145333664
phosphorosobenzene;pyridine
CID 174856608
oxo(dipyridin-3-yl)phosphanium
CID 150603186
1,5-dipyridin-4-ylpenta-1,4-diyn-3-one
CID 143015613

Frequently Asked Questions

What is the IUPAC name of hydroxy-oxo-pyridin-4-ylphosphanium?
The IUPAC name of hydroxy-oxo-pyridin-4-ylphosphanium (CID 150562998) is hydroxy-oxo-pyridin-4-ylphosphanium.
What is the SMILES notation for hydroxy-oxo-pyridin-4-ylphosphanium?
The canonical SMILES for hydroxy-oxo-pyridin-4-ylphosphanium is O=[P+](O)c1ccncc1.
What is the InChIKey of hydroxy-oxo-pyridin-4-ylphosphanium?
The InChIKey is OAVUZDJHFXCSQR-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H4NO2P/c7-9(8)5-1-3-6-4-2-5/h1-4H/p+1.
What are the key properties of hydroxy-oxo-pyridin-4-ylphosphanium?
hydroxy-oxo-pyridin-4-ylphosphanium has a molecular weight of 142.07 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-oxo-pyridin-4-ylphosphanium is sourced from PubChem (CID 150562998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).