2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)

C26H25N3Pt — CID 153483659

IUPAC2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)
SMILESCCC(CC)(c1cccc(-c2[c-]cccc2)n1)c1cn(C)c(-c2[c-]cccc2)n1.[Pt+2]
InChIInChI=1S/C26H25N3.Pt/c1-4-26(5-2,23-18-12-17-22(27-23)20-13-8-6-9-14-20)24-19-29(3)25(28-24)21-15-10-7-11-16-21;/h6-13,15,17-19H,4-5H2,1-3H3;/q-2;+2
InChIKeyHBPDPWKCFZSMPJ-UHFFFAOYSA-N
MW574.59 g/mol
LogP5.85
Rot. Bonds6

About 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)

2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+) (PubChem CID 153483659) has the molecular formula C26H25N3Pt and a molecular weight of 574.59 g/mol. Its IUPAC name is 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+).

Molecular Properties

Compound Name2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)
PubChem CID153483659
Molecular FormulaC26H25N3Pt
Molecular Weight574.59 g/mol
Exact Mass574.17
IUPAC Name2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)
SMILESCCC(CC)(c1cccc(-c2[c-]cccc2)n1)c1cn(C)c(-c2[c-]cccc2)n1.[Pt+2]
InChIInChI=1S/C26H25N3.Pt/c1-4-26(5-2,23-18-12-17-22(27-23)20-13-8-6-9-14-20)24-19-29(3)25(28-24)21-15-10-7-11-16-21;/h6-13,15,17-19H,4-5H2,1-3H3;/q-2;+2
InChIKeyHBPDPWKCFZSMPJ-UHFFFAOYSA-N
XLogP5.85
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.59
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

iridium;1-methyl-4-phenyl-2-phenylimidazole;2-phenylpyridine
CID 170539604
chloronickel;2,6-di(phenyl)pyridine
CID 153499161
iridium(3+);2-(3-methylbenzene-6-id-1-yl)-6-[4-phenyl-1-(6-phenyl-2-pyridinyl)-1-pyrazol-1-ylbutyl]pyridine
CID 58621374
ethane;methanethiol;platinum(2+);2-(4H-pyridin-4-id-3-yl)-6-[2-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine
CID 145489398
nickel;2-[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]phenol
CID 153499066
CID 153499114
CID 153499114
iridium;2-methyl-3-phenyl-6-phenylpyridine
CID 58435059
2-phenyl-6-[phenyl-(6-phenyl-2-pyridinyl)methyl]pyridine;platinum(2+)
CID 59434494
chloroplatinum(1+);2-(1-methylimidazol-2-yl)-6-(2-phenylpropan-2-yl)pyridine
CID 140804372
iridium;1-methyl-2-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]imidazole;6-phenylpyridine-2-carboxylic acid
CID 58898333
bromonickel;2-phenyl-6-pyridin-2-ylpyridine
CID 153499013
iridium;10-methyl-2-phenyl-1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12),9-pentaene;2-methyl-6-phenylpyridine
CID 170777199

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)?
The IUPAC name of 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+) (CID 153483659) is 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+).
What is the SMILES notation for 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)?
The canonical SMILES for 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+) is CCC(CC)(c1cccc(-c2[c-]cccc2)n1)c1cn(C)c(-c2[c-]cccc2)n1.[Pt+2].
What is the InChIKey of 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)?
The InChIKey is HBPDPWKCFZSMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3.Pt/c1-4-26(5-2,23-18-12-17-22(27-23)20-13-8-6-9-14-20)24-19-29(3)25(28-24)21-15-10-7-11-16-21;/h6-13,15,17-19H,4-5H2,1-3H3;/q-2;+2.
What are the key properties of 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+)?
2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+) has a molecular weight of 574.59 g/mol, XLogP of 5.85, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1-methyl-2-phenylimidazol-4-yl)pentan-3-yl]-6-phenylpyridine;platinum(2+) is sourced from PubChem (CID 153483659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).