(5-iodo-3-pyridinyl)oxyphosphane

C5H5INOP — CID 155258572

IUPAC(5-iodo-3-pyridinyl)oxyphosphane
SMILESPOc1cncc(I)c1
InChIInChI=1S/C5H5INOP/c6-4-1-5(8-9)3-7-2-4/h1-3H,9H2
InChIKeyJGROHIUAGNCINS-UHFFFAOYSA-N
MW252.98 g/mol
LogP1.86
Rot. Bonds1

About (5-iodo-3-pyridinyl)oxyphosphane

(5-iodo-3-pyridinyl)oxyphosphane (PubChem CID 155258572) has the molecular formula C5H5INOP and a molecular weight of 252.98 g/mol. Its IUPAC name is (5-iodo-3-pyridinyl)oxyphosphane.

Molecular Properties

Compound Name(5-iodo-3-pyridinyl)oxyphosphane
PubChem CID155258572
Molecular FormulaC5H5INOP
Molecular Weight252.98 g/mol
Exact Mass252.92
IUPAC Name(5-iodo-3-pyridinyl)oxyphosphane
SMILESPOc1cncc(I)c1
InChIInChI=1S/C5H5INOP/c6-4-1-5(8-9)3-7-2-4/h1-3H,9H2
InChIKeyJGROHIUAGNCINS-UHFFFAOYSA-N
XLogP1.86
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.98
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5-iodo-3-pyridinyl)oxyphosphane?
The IUPAC name of (5-iodo-3-pyridinyl)oxyphosphane (CID 155258572) is (5-iodo-3-pyridinyl)oxyphosphane.
What is the SMILES notation for (5-iodo-3-pyridinyl)oxyphosphane?
The canonical SMILES for (5-iodo-3-pyridinyl)oxyphosphane is POc1cncc(I)c1.
What is the InChIKey of (5-iodo-3-pyridinyl)oxyphosphane?
The InChIKey is JGROHIUAGNCINS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5INOP/c6-4-1-5(8-9)3-7-2-4/h1-3H,9H2.
What are the key properties of (5-iodo-3-pyridinyl)oxyphosphane?
(5-iodo-3-pyridinyl)oxyphosphane has a molecular weight of 252.98 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-iodo-3-pyridinyl)oxyphosphane is sourced from PubChem (CID 155258572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).