platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine

C22H15F6N5Pt — CID 140853669

IUPACplatinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine
SMILESCC(C)(c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1)c1cccc(-c2cc(C(F)(F)F)n[n-]2)n1.[Pt+2]
InChIInChI=1S/C22H15F6N5.Pt/c1-20(2,17-7-3-5-13(30-17)15-9-12(11-29-15)21(23,24)25)18-8-4-6-14(31-18)16-10-19(33-32-16)22(26,27)28;/h3-11H,1-2H3;/q-2;+2
InChIKeySWWORRUYIVPYFD-UHFFFAOYSA-N
MW658.46 g/mol
LogP5.48
Rot. Bonds4

About platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine

platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine (PubChem CID 140853669) has the molecular formula C22H15F6N5Pt and a molecular weight of 658.46 g/mol. Its IUPAC name is platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine.

Molecular Properties

Compound Nameplatinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine
PubChem CID140853669
Molecular FormulaC22H15F6N5Pt
Molecular Weight658.46 g/mol
Exact Mass658.09
IUPAC Nameplatinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine
SMILESCC(C)(c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1)c1cccc(-c2cc(C(F)(F)F)n[n-]2)n1.[Pt+2]
InChIInChI=1S/C22H15F6N5.Pt/c1-20(2,17-7-3-5-13(30-17)15-9-12(11-29-15)21(23,24)25)18-8-4-6-14(31-18)16-10-19(33-32-16)22(26,27)28;/h3-11H,1-2H3;/q-2;+2
InChIKeySWWORRUYIVPYFD-UHFFFAOYSA-N
XLogP5.48
TPSA66.87 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500658.46
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Bis{mu~2~-3-[3-(2-pyridyl)pyrazol-1-ylmethyl]pyridine-kappa^3^N^1^:N^2^,N^3^}disilver(I) bis(trifluoromethanesulfonate)
CID 139060498
Bis(2-[3,5-bis(trifluoromethyl)pyrrol-1-id-2-yl]pyridine);platinum(2+)
CID 139127932
Platinum(2+);pyrazol-1-ide;2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 139131682
3,5-Ditert-butylpyrazol-1-ide;hexane;bis(platinum(2+));2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-pyridin-2-yl-6-[5-(trifluoromethyl)pyrazol-1-id-3-yl]pyridine;trifluoromethanesulfonate;hydrate
CID 139131684
3,5-Bis(trifluoromethyl)pyrazol-1-ide;platinum(2+);2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 139131685
Bis(2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)pyrazol-1-id-3-yl]pyridine);platinum(2+)
CID 139138252
Bis(platinum(2+));propan-2-one;bis(pyrazol-1-ide);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
CID 139141460
4-[2,6-Di(propan-2-yl)phenyl]-1-[3-(trifluoromethyl)pyrazol-1-id-5-yl]isoquinoline;4-[2,6-di(propan-2-yl)phenyl]-1-[5-(trifluoromethyl)pyrazol-1-id-3-yl]isoquinoline;platinum(2+)
CID 139165520
Bis(5-[2,6-di(propan-2-yl)phenyl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);platinum(2+)
CID 168338735
Bis(dichloromethane);platinum(2+);3-(trifluoromethyl)-5-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyrazol-1-ide;4-(2,4,6-trimethylphenyl)-2-[4-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
CID 168338993
2-(3-Tert-butylpyrazol-1-id-5-yl)-5-methylpyrazine;2-(5-tert-butylpyrazol-1-id-3-yl)-5-methylpyrazine;platinum(2+)
CID 139138251
2-(2,4-Difluorobenzene-6-id-1-yl)-4-methylpyridine;iridium;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 20625479

Frequently Asked Questions

What is the IUPAC name of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?
The IUPAC name of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine (CID 140853669) is platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine.
What is the SMILES notation for platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?
The canonical SMILES for platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine is CC(C)(c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1)c1cccc(-c2cc(C(F)(F)F)n[n-]2)n1.[Pt+2].
What is the InChIKey of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?
The InChIKey is SWWORRUYIVPYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15F6N5.Pt/c1-20(2,17-7-3-5-13(30-17)15-9-12(11-29-15)21(23,24)25)18-8-4-6-14(31-18)16-10-19(33-32-16)22(26,27)28;/h3-11H,1-2H3;/q-2;+2.
What are the key properties of platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?
platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine has a molecular weight of 658.46 g/mol, XLogP of 5.48, 4 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]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine is sourced from PubChem (CID 140853669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).