platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine

C19H11F6N5Pt — CID 140635950

IUPACplatinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine
SMILESFC(F)(F)c1c[n-]c(-c2ccccn2)c1.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.[Pt+2]
InChIInChI=1S/C10H6F3N2.C9H5F3N3.Pt/c11-10(12,13)7-5-9(15-6-7)8-3-1-2-4-14-8;10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;/h1-6H;1-5H;/q2*-1;+2
InChIKeyFVPXHPMBNCMNGT-UHFFFAOYSA-N
MW618.40 g/mol
LogP4.84
Rot. Bonds2

About platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine

platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine (PubChem CID 140635950) has the molecular formula C19H11F6N5Pt and a molecular weight of 618.40 g/mol. Its IUPAC name is platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine.

Molecular Properties

Compound Nameplatinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine
PubChem CID140635950
Molecular FormulaC19H11F6N5Pt
Molecular Weight618.40 g/mol
Exact Mass618.06
IUPAC Nameplatinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine
SMILESFC(F)(F)c1c[n-]c(-c2ccccn2)c1.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.[Pt+2]
InChIInChI=1S/C10H6F3N2.C9H5F3N3.Pt/c11-10(12,13)7-5-9(15-6-7)8-3-1-2-4-14-8;10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;/h1-6H;1-5H;/q2*-1;+2
InChIKeyFVPXHPMBNCMNGT-UHFFFAOYSA-N
XLogP4.84
TPSA66.87 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500618.40
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine?
The IUPAC name of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine (CID 140635950) is platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine.
What is the SMILES notation for platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine?
The canonical SMILES for platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine is FC(F)(F)c1c[n-]c(-c2ccccn2)c1.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.[Pt+2].
What is the InChIKey of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine?
The InChIKey is FVPXHPMBNCMNGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F3N2.C9H5F3N3.Pt/c11-10(12,13)7-5-9(15-6-7)8-3-1-2-4-14-8;10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;/h1-6H;1-5H;/q2*-1;+2.
What are the key properties of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine?
platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine has a molecular weight of 618.40 g/mol, XLogP of 4.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]pyridine is sourced from PubChem (CID 140635950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).