platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol

C21H14N3O2Pt- — CID 153280343

IUPACplatinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol
SMILESOc1ccccc1-c1[c-]c(-c2cccc(Oc3ccccn3)n2)ccn1.[Pt]
InChIInChI=1S/C21H14N3O2.Pt/c25-19-8-2-1-6-16(19)18-14-15(11-13-22-18)17-7-5-10-21(24-17)26-20-9-3-4-12-23-20;/h1-13,25H;/q-1;
InChIKeyANUUZFYIJPVQOH-UHFFFAOYSA-N
MW535.44 g/mol
LogP4.50
Rot. Bonds4

About platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol

platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol (PubChem CID 153280343) has the molecular formula C21H14N3O2Pt- and a molecular weight of 535.44 g/mol. Its IUPAC name is platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol.

Molecular Properties

Compound Nameplatinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol
PubChem CID153280343
Molecular FormulaC21H14N3O2Pt-
Molecular Weight535.44 g/mol
Exact Mass535.07
IUPAC Nameplatinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol
SMILESOc1ccccc1-c1[c-]c(-c2cccc(Oc3ccccn3)n2)ccn1.[Pt]
InChIInChI=1S/C21H14N3O2.Pt/c25-19-8-2-1-6-16(19)18-14-15(11-13-22-18)17-7-5-10-21(24-17)26-20-9-3-4-12-23-20;/h1-13,25H;/q-1;
InChIKeyANUUZFYIJPVQOH-UHFFFAOYSA-N
XLogP4.50
TPSA68.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500535.44
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol?
The IUPAC name of platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol (CID 153280343) is platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol.
What is the SMILES notation for platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol?
The canonical SMILES for platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol is Oc1ccccc1-c1[c-]c(-c2cccc(Oc3ccccn3)n2)ccn1.[Pt].
What is the InChIKey of platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol?
The InChIKey is ANUUZFYIJPVQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N3O2.Pt/c25-19-8-2-1-6-16(19)18-14-15(11-13-22-18)17-7-5-10-21(24-17)26-20-9-3-4-12-23-20;/h1-13,25H;/q-1;.
What are the key properties of platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol?
platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol has a molecular weight of 535.44 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol is sourced from PubChem (CID 153280343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).