diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane

C17H14NPS — CID 3296042

IUPACdiphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane
SMILESS=P(c1ccccc1)(c1ccccc1)c1ccccn1
InChIInChI=1S/C17H14NPS/c20-19(15-9-3-1-4-10-15,16-11-5-2-6-12-16)17-13-7-8-14-18-17/h1-14H
InChIKeyDPDYLMSARNAKJZ-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.84
Rot. Bonds3

About diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane

diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane (PubChem CID 3296042) has the molecular formula C17H14NPS and a molecular weight of 295.35 g/mol. Its IUPAC name is diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane.

Molecular Properties

Compound Namediphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane
PubChem CID3296042
Molecular FormulaC17H14NPS
Molecular Weight295.35 g/mol
Exact Mass295.06
IUPAC Namediphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane
SMILESS=P(c1ccccc1)(c1ccccc1)c1ccccn1
InChIInChI=1S/C17H14NPS/c20-19(15-9-3-1-4-10-15,16-11-5-2-6-12-16)17-13-7-8-14-18-17/h1-14H
InChIKeyDPDYLMSARNAKJZ-UHFFFAOYSA-N
XLogP2.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane?
The IUPAC name of diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane (CID 3296042) is diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane.
What is the SMILES notation for diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane?
The canonical SMILES for diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane is S=P(c1ccccc1)(c1ccccc1)c1ccccn1.
What is the InChIKey of diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane?
The InChIKey is DPDYLMSARNAKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14NPS/c20-19(15-9-3-1-4-10-15,16-11-5-2-6-12-16)17-13-7-8-14-18-17/h1-14H.
What are the key properties of diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane?
diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane has a molecular weight of 295.35 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-pyridin-2-yl-sulfanylidene-lambda5-phosphane is sourced from PubChem (CID 3296042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).