platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid

C20H17N2O3Pt- — CID 58709003

IUPACplatinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid
SMILESCC(C)(c1[c-]c(Oc2ccccn2)ccc1)c1cccc(C(=O)O)n1.[Pt]
InChIInChI=1S/C20H17N2O3.Pt/c1-20(2,17-10-6-9-16(22-17)19(23)24)14-7-5-8-15(13-14)25-18-11-3-4-12-21-18;/h3-12H,1-2H3,(H,23,24);/q-1;
InChIKeyKAXFGPDXONZXEI-UHFFFAOYSA-N
MW528.45 g/mol
LogP4.09
Rot. Bonds5

About platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid

platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid (PubChem CID 58709003) has the molecular formula C20H17N2O3Pt- and a molecular weight of 528.45 g/mol. Its IUPAC name is platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Nameplatinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid
PubChem CID58709003
Molecular FormulaC20H17N2O3Pt-
Molecular Weight528.45 g/mol
Exact Mass528.09
IUPAC Nameplatinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid
SMILESCC(C)(c1[c-]c(Oc2ccccn2)ccc1)c1cccc(C(=O)O)n1.[Pt]
InChIInChI=1S/C20H17N2O3.Pt/c1-20(2,17-10-6-9-16(22-17)19(23)24)14-7-5-8-15(13-14)25-18-11-3-4-12-21-18;/h3-12H,1-2H3,(H,23,24);/q-1;
InChIKeyKAXFGPDXONZXEI-UHFFFAOYSA-N
XLogP4.09
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500528.45
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid with MolForge

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Related Compounds

2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine;platinum(2+)
CID 58709031
phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)
CID 58709094
platinum(2+);6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine-2-carbothioate
CID 58709124
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
2-tert-butyl-6-pyridin-2-yloxypyridine
CID 176632030
9-phenyl-3-pyridin-2-yloxy-6-(2-pyridin-2-ylpropan-2-yl)-4,5-dihydrocarbazole-4,5-diide;platinum(2+)
CID 153433428
2-[4-(2-phenylpropan-2-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum
CID 164742231
2-[2-[6-[diphenyl-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]silyl]-2-pyridinyl]propan-2-yl]phenol;platinum;2-[3-[(6-pyridin-2-yloxy-2-pyridinyl)oxy]benzene-2-id-1-yl]oxyphenol;2-[3-[2-(6-pyridin-2-yloxy-2-pyridinyl)propan-2-yl]benzene-2-id-1-yl]oxyphenol;2-[2-[6-(N-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]anilino)-2-pyridinyl]propan-2-yl]phenol;2-[2-[3-[[6-(2-pyridin-2-ylpropan-2-yl)-2-pyridinyl]oxy]benzene-2-id-1-yl]propan-2-yl]phenol;2-[3-[2-[6-(2-pyridin-2-ylpropan-2-yl)-2-pyridinyl]propan-2-yl]benzene-2-id-1-yl]oxyphenol
CID 161164437
6-(2-methyl-3-oxobutan-2-yl)pyridine-2-carboxylic acid
CID 118860112
4-methyl-3-pyridin-2-yloxybenzoic acid
CID 55031137
3-chloro-4-pyridin-2-yloxybenzoic acid
CID 59625693
2,4-ditert-butyl-6-[5-phenyl-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)-2-pyridinyl]phenol;platinum
CID 153304201

Frequently Asked Questions

What is the IUPAC name of platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid?
The IUPAC name of platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid (CID 58709003) is platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid.
What is the SMILES notation for platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid?
The canonical SMILES for platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid is CC(C)(c1[c-]c(Oc2ccccn2)ccc1)c1cccc(C(=O)O)n1.[Pt].
What is the InChIKey of platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid?
The InChIKey is KAXFGPDXONZXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N2O3.Pt/c1-20(2,17-10-6-9-16(22-17)19(23)24)14-7-5-8-15(13-14)25-18-11-3-4-12-21-18;/h3-12H,1-2H3,(H,23,24);/q-1;.
What are the key properties of platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid?
platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid has a molecular weight of 528.45 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for platinum;6-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyridine-2-carboxylic acid is sourced from PubChem (CID 58709003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).