1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum

C23H21N2Pt- — CID 58947398

IUPAC1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum
SMILESCC(C)Cc1ccccc1-n1ccnc1-c1[c-]cc2ccccc2c1.[Pt]
InChIInChI=1S/C23H21N2.Pt/c1-17(2)15-20-9-5-6-10-22(20)25-14-13-24-23(25)21-12-11-18-7-3-4-8-19(18)16-21;/h3-11,13-14,16-17H,15H2,1-2H3;/q-1;
InChIKeyKLHYIPXWZHDKTH-UHFFFAOYSA-N
MW520.51 g/mol
LogP5.69
Rot. Bonds4

About 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum

1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum (PubChem CID 58947398) has the molecular formula C23H21N2Pt- and a molecular weight of 520.51 g/mol. Its IUPAC name is 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum.

Molecular Properties

Compound Name1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum
PubChem CID58947398
Molecular FormulaC23H21N2Pt-
Molecular Weight520.51 g/mol
Exact Mass520.14
IUPAC Name1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum
SMILESCC(C)Cc1ccccc1-n1ccnc1-c1[c-]cc2ccccc2c1.[Pt]
InChIInChI=1S/C23H21N2.Pt/c1-17(2)15-20-9-5-6-10-22(20)25-14-13-24-23(25)21-12-11-18-7-3-4-8-19(18)16-21;/h3-11,13-14,16-17H,15H2,1-2H3;/q-1;
InChIKeyKLHYIPXWZHDKTH-UHFFFAOYSA-N
XLogP5.69
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500520.51
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum?
The IUPAC name of 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum (CID 58947398) is 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum.
What is the SMILES notation for 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum?
The canonical SMILES for 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum is CC(C)Cc1ccccc1-n1ccnc1-c1[c-]cc2ccccc2c1.[Pt].
What is the InChIKey of 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum?
The InChIKey is KLHYIPXWZHDKTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N2.Pt/c1-17(2)15-20-9-5-6-10-22(20)25-14-13-24-23(25)21-12-11-18-7-3-4-8-19(18)16-21;/h3-11,13-14,16-17H,15H2,1-2H3;/q-1;.
What are the key properties of 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum?
1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum has a molecular weight of 520.51 g/mol, XLogP of 5.69, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylpropyl)phenyl]-2-(3H-naphthalen-3-id-2-yl)imidazole;platinum is sourced from PubChem (CID 58947398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).