2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum

C31H25N2O2Pt- — CID 164742231

IUPAC2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum
SMILESCC(C)(c1ccccc1)c1cc(-c2[c-]c(Oc3ccccn3)ccc2)nc(-c2ccccc2O)c1.[Pt]
InChIInChI=1S/C31H25N2O2.Pt/c1-31(2,23-12-4-3-5-13-23)24-20-27(33-28(21-24)26-15-6-7-16-29(26)34)22-11-10-14-25(19-22)35-30-17-8-9-18-32-30;/h3-18,20-21,34H,1-2H3;/q-1;
InChIKeyZDRPZRTZULQOHW-UHFFFAOYSA-N
MW652.63 g/mol
LogP7.43
Rot. Bonds6

About 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum

2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum (PubChem CID 164742231) has the molecular formula C31H25N2O2Pt- and a molecular weight of 652.63 g/mol. Its IUPAC name is 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum.

Molecular Properties

Compound Name2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum
PubChem CID164742231
Molecular FormulaC31H25N2O2Pt-
Molecular Weight652.63 g/mol
Exact Mass652.16
IUPAC Name2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum
SMILESCC(C)(c1ccccc1)c1cc(-c2[c-]c(Oc3ccccn3)ccc2)nc(-c2ccccc2O)c1.[Pt]
InChIInChI=1S/C31H25N2O2.Pt/c1-31(2,23-12-4-3-5-13-23)24-20-27(33-28(21-24)26-15-6-7-16-29(26)34)22-11-10-14-25(19-22)35-30-17-8-9-18-32-30;/h3-18,20-21,34H,1-2H3;/q-1;
InChIKeyZDRPZRTZULQOHW-UHFFFAOYSA-N
XLogP7.43
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500652.63
LogP ≤ 57.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum with MolForge

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Related Compounds

platinum;2-[6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-4-(2,4,6-trimethylphenyl)-2-pyridinyl]phenol
CID 153304161
2-[4-tert-butyl-6-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyridinyl]phenol;nickel
CID 153499003
2-[4-(3,5-ditert-butylphenyl)-6-(3-phenyl-5-pyridin-2-yloxybenzene-6-id-1-yl)pyrimidin-2-yl]phenol;platinum
CID 153280372
2-[6-(3-isoquinolin-1-yloxybenzene-2-id-1-yl)-4-phenyl-2-pyridinyl]phenol;platinum
CID 153304045
2,4-ditert-butyl-6-[5-phenyl-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum
CID 153304201
2-[6-[3-(2-phenylpropan-2-yl)-5-(N-pyridin-2-ylanilino)benzene-6-id-1-yl]-2-pyridinyl]phenol;platinum
CID 164742111
2-[4-phenyl-6-(3-pyridin-2-yloxyphenyl)-2-pyridinyl]phenol
CID 153304016
platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol
CID 153280343
2-[6-[3-[4-(4-tert-butylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-4-(3,5-ditert-butylphenyl)-2-pyridinyl]phenol;platinum
CID 162471850
2-[6-[3-[[4-(4-benzylphenyl)-2-pyridinyl]oxy]-5-tert-butylbenzene-2-id-1-yl]-4-phenyl-2-pyridinyl]phenol;platinum
CID 164743217
2-[4-(3,5-ditert-butylphenyl)-6-[3-(2-phenyl-N-pyridin-2-ylanilino)benzene-2-id-1-yl]-2-pyridinyl]phenol;methane;platinum
CID 159267999
iridium(3+);2-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy-6-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine
CID 140597838

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum?
The IUPAC name of 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum (CID 164742231) is 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum.
What is the SMILES notation for 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum?
The canonical SMILES for 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum is CC(C)(c1ccccc1)c1cc(-c2[c-]c(Oc3ccccn3)ccc2)nc(-c2ccccc2O)c1.[Pt].
What is the InChIKey of 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum?
The InChIKey is ZDRPZRTZULQOHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H25N2O2.Pt/c1-31(2,23-12-4-3-5-13-23)24-20-27(33-28(21-24)26-15-6-7-16-29(26)34)22-11-10-14-25(19-22)35-30-17-8-9-18-32-30;/h3-18,20-21,34H,1-2H3;/q-1;.
What are the key properties of 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum?
2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum has a molecular weight of 652.63 g/mol, XLogP of 7.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum is sourced from PubChem (CID 164742231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).