5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum

About 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum

5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum (PubChem CID 146899307) has the molecular formula C17H16F3N8Pt-3 and a molecular weight of 584.44 g/mol. Its IUPAC name is 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum.

Molecular Properties

Compound Name	5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum
PubChem CID	146899307
Molecular Formula	C17H16F3N8Pt-3
Molecular Weight	584.44 g/mol
Exact Mass	584.11
IUPAC Name	5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum
SMILES	Cc1n[c-]c(N2C=CN(C)[CH-]2)cn1.Cn1ccnc1-c1cc(C(F)(F)F)n[n-]1.[Pt]
InChI	InChI=1S/C9H10N4.C8H6F3N4.Pt/c1-8-10-5-9(6-11-8)13-4-3-12(2)7-13;1-15-3-2-12-7(15)5-4-6(14-13-5)8(9,10)11;/h3-5,7H,1-2H3;2-4H,1H3;/q-2;-1;
InChIKey	DZDRIAJTECUYIH-UHFFFAOYSA-N
XLogP	2.38
TPSA	77.07 Å²
H-Bond Donors
H-Bond Acceptors	7
Rotatable Bonds	2
Heavy Atoms	29
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	584.44
LogP ≤ 5	2.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum?

The IUPAC name of 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum (CID 146899307) is 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum.

What is the SMILES notation for 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum?

The canonical SMILES for 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum is Cc1n[c-]c(N2C=CN(C)[CH-]2)cn1.Cn1ccnc1-c1cc(C(F)(F)F)n[n-]1.[Pt].

What is the InChIKey of 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum?

The InChIKey is DZDRIAJTECUYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4.C8H6F3N4.Pt/c1-8-10-5-9(6-11-8)13-4-3-12(2)7-13;1-15-3-2-12-7(15)5-4-6(14-13-5)8(9,10)11;/h3-5,7H,1-2H3;2-4H,1H3;/q-2;-1;.

What are the key properties of 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum?

5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum has a molecular weight of 584.44 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(1-methylimidazol-2-yl)-3-(trifluoromethyl)pyrazol-1-ide;2-methyl-5-(3-methyl-2H-imidazol-2-id-1-yl)-4H-pyrimidin-4-ide;platinum is sourced from PubChem (CID 146899307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).