diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane

C23H19NP+ — CID 102340205

IUPACdiphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane
SMILESc1ccc(-[n+]2ccccc2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H19NP/c1-4-12-20(13-5-1)24-19-11-10-18-23(24)25(21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-19H/q+1
InChIKeyGIFFEDPFBSWPFE-UHFFFAOYSA-N
MW340.39 g/mol
LogP3.72
Rot. Bonds4

About diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane

diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane (PubChem CID 102340205) has the molecular formula C23H19NP+ and a molecular weight of 340.39 g/mol. Its IUPAC name is diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane.

Molecular Properties

Compound Namediphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane
PubChem CID102340205
Molecular FormulaC23H19NP+
Molecular Weight340.39 g/mol
Exact Mass340.12
IUPAC Namediphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane
SMILESc1ccc(-[n+]2ccccc2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H19NP/c1-4-12-20(13-5-1)24-19-11-10-18-23(24)25(21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-19H/q+1
InChIKeyGIFFEDPFBSWPFE-UHFFFAOYSA-N
XLogP3.72
TPSA3.88 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane?
The IUPAC name of diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane (CID 102340205) is diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane.
What is the SMILES notation for diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane?
The canonical SMILES for diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane is c1ccc(-[n+]2ccccc2P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane?
The InChIKey is GIFFEDPFBSWPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NP/c1-4-12-20(13-5-1)24-19-11-10-18-23(24)25(21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-19H/q+1.
What are the key properties of diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane?
diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane has a molecular weight of 340.39 g/mol, XLogP of 3.72, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(1-phenylpyridin-1-ium-2-yl)phosphane is sourced from PubChem (CID 102340205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).