oxo(dipyridin-3-yl)phosphanium

C10H8N2OP+ — CID 150603186

IUPACoxo(dipyridin-3-yl)phosphanium
SMILESO=[P+](c1cccnc1)c1cccnc1
InChIInChI=1S/C10H8N2OP/c13-14(9-3-1-5-11-7-9)10-4-2-6-12-8-10/h1-8H/q+1
InChIKeyDFEOBLFRTLTWGC-UHFFFAOYSA-N
MW203.16 g/mol
LogP1.25
Rot. Bonds2

About oxo(dipyridin-3-yl)phosphanium

oxo(dipyridin-3-yl)phosphanium (PubChem CID 150603186) has the molecular formula C10H8N2OP+ and a molecular weight of 203.16 g/mol. Its IUPAC name is oxo(dipyridin-3-yl)phosphanium.

Molecular Properties

Compound Nameoxo(dipyridin-3-yl)phosphanium
PubChem CID150603186
Molecular FormulaC10H8N2OP+
Molecular Weight203.16 g/mol
Exact Mass203.04
IUPAC Nameoxo(dipyridin-3-yl)phosphanium
SMILESO=[P+](c1cccnc1)c1cccnc1
InChIInChI=1S/C10H8N2OP/c13-14(9-3-1-5-11-7-9)10-4-2-6-12-8-10/h1-8H/q+1
InChIKeyDFEOBLFRTLTWGC-UHFFFAOYSA-N
XLogP1.25
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.16
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

sodium oxido-oxo-pyridin-3-yloxyphosphanium
CID 141390427
bis(dihydroxy(oxo)phosphanium);2-pyridin-3-ylethenol
CID 159880051
dichloro(pyridin-3-yl)-λ3-iodane
CID 58308214
3-bromopyridine
CID 143579676
cyclopenta[c]azepine
CID 638010
pyridin-3-olate
CID 14387722
3-(18F)fluoropyridine
CID 24871782
pyridin-3-ylmercury
CID 163821117
pyridin-3-ylastatine
CID 140653645
2,6-dipyridin-3-ylpyridine
CID 13349632
3-fluoroazepin-4-one
CID 69032704
pyridin-3-ol;titanium(3+);trichloride
CID 19362153

Frequently Asked Questions

What is the IUPAC name of oxo(dipyridin-3-yl)phosphanium?
The IUPAC name of oxo(dipyridin-3-yl)phosphanium (CID 150603186) is oxo(dipyridin-3-yl)phosphanium.
What is the SMILES notation for oxo(dipyridin-3-yl)phosphanium?
The canonical SMILES for oxo(dipyridin-3-yl)phosphanium is O=[P+](c1cccnc1)c1cccnc1.
What is the InChIKey of oxo(dipyridin-3-yl)phosphanium?
The InChIKey is DFEOBLFRTLTWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2OP/c13-14(9-3-1-5-11-7-9)10-4-2-6-12-8-10/h1-8H/q+1.
What are the key properties of oxo(dipyridin-3-yl)phosphanium?
oxo(dipyridin-3-yl)phosphanium has a molecular weight of 203.16 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxo(dipyridin-3-yl)phosphanium is sourced from PubChem (CID 150603186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).