fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine

C26H18F4N2Pt — CID 21024849

IUPACfluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine
SMILESCc1cc(/C(=N/c2ccccc2)c2ccccc2)[c-]c(-c2cc(C(F)(F)F)ccn2)c1.F[Pt+]
InChIInChI=1S/C26H18F3N2.FH.Pt/c1-18-14-20(24-17-22(12-13-30-24)26(27,28)29)16-21(15-18)25(19-8-4-2-5-9-19)31-23-10-6-3-7-11-23;;/h2-15,17H,1H3;1H;/q-1;;+2/p-1/b31-25+;;
InChIKeyIWVRYYTZJQNRDH-ARXDYCJMSA-M
MW629.51 g/mol
LogP7.46
Rot. Bonds4

About fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine

fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine (PubChem CID 21024849) has the molecular formula C26H18F4N2Pt and a molecular weight of 629.51 g/mol. Its IUPAC name is fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine.

Molecular Properties

Compound Namefluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine
PubChem CID21024849
Molecular FormulaC26H18F4N2Pt
Molecular Weight629.51 g/mol
Exact Mass629.11
IUPAC Namefluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine
SMILESCc1cc(/C(=N/c2ccccc2)c2ccccc2)[c-]c(-c2cc(C(F)(F)F)ccn2)c1.F[Pt+]
InChIInChI=1S/C26H18F3N2.FH.Pt/c1-18-14-20(24-17-22(12-13-30-24)26(27,28)29)16-21(15-18)25(19-8-4-2-5-9-19)31-23-10-6-3-7-11-23;;/h2-15,17H,1H3;1H;/q-1;;+2/p-1/b31-25+;;
InChIKeyIWVRYYTZJQNRDH-ARXDYCJMSA-M
XLogP7.46
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500629.51
LogP ≤ 57.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Triprolidine
CID 5282443
(+-)-Dimethindene
CID 21855
Pheniramine
CID 4761
Pyridinium, 2-[2-[4-(dimethylamino)phenyl]ethenyl]-1-ethyl-, iodide (1:1)
CID 5713123
1-Phenethyl-2-picolinium bromide
CID 82720
Dimetindene, (R)-
CID 12963076
(+)-Dimethindene
CID 6604866
Pyridinium, 2-[2-[4-(dimethylamino)phenyl]ethenyl]-1-ethyl-, iodide
CID 107464
2-(2-(4-(Diethylamino)phenyl)vinyl)-1-ethylpyridinium iodide
CID 45049277
2-(4-(Dimethylamino)styryl)pyridine
CID 5376425
2,5-Diphenylpyrazine
CID 220958
4,4'-Diphenyl-2,2'-bipyridine
CID 80259

Frequently Asked Questions

What is the IUPAC name of fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine?
The IUPAC name of fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine (CID 21024849) is fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine.
What is the SMILES notation for fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine?
The canonical SMILES for fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine is Cc1cc(/C(=N/c2ccccc2)c2ccccc2)[c-]c(-c2cc(C(F)(F)F)ccn2)c1.F[Pt+].
What is the InChIKey of fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine?
The InChIKey is IWVRYYTZJQNRDH-ARXDYCJMSA-M. The full InChI is InChI=1S/C26H18F3N2.FH.Pt/c1-18-14-20(24-17-22(12-13-30-24)26(27,28)29)16-21(15-18)25(19-8-4-2-5-9-19)31-23-10-6-3-7-11-23;;/h2-15,17H,1H3;1H;/q-1;;+2/p-1/b31-25+;;.
What are the key properties of fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine?
fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine has a molecular weight of 629.51 g/mol, XLogP of 7.46, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroplatinum(1+);1-[3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]benzene-6-id-1-yl]-N,1-diphenylmethanimine is sourced from PubChem (CID 21024849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).