2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride

C93H95Br3F19N21Pt — CID 159299263

IUPAC2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride
SMILESBrc1cccc(Br)n1.C.C.C.CC(C)c1cccc(C(C)C)c1N.CC(C)c1cccc(C(C)C)c1N(c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1)c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1.CC(C)c1cccc(C(C)C)c1N(c1cccc(-n2ccc(C(F)(F)F)n2)n1)c1cccc(-n2ccc(C(F)(F)F)n2)n1.F.FC(F)(F)c1ccn(-c2cccc(Br)n2)n1.FC(F)(F)c1ccn[nH]1.[Pt+2]
InChIInChI=1S/C30H27F6N7.C30H25F6N7.C12H19N.C9H5BrF3N3.C5H3Br2N.C4H3F3N2.3CH4.FH.Pt/c2*1-18(2)20-8-5-9-21(19(3)4)28(20)43(26-12-6-10-24(37-26)41-16-14-22(39-41)29(31,32)33)27-13-7-11-25(38-27)42-17-15-23(40-42)30(34,35)36;1-8(2)10-6-5-7-11(9(3)4)12(10)13;10-7-2-1-3-8(14-7)16-5-4-6(15-16)9(11,12)13;6-4-2-1-3-5(7)8-4;5-4(6,7)3-1-2-8-9-3;;;;;/h5-19H,1-4H3;5-15,18-19H,1-4H3;5-9H,13H2,1-4H3;1-5H;1-3H;1-2H,(H,8,9);3*1H4;1H;/q;-2;;;;;;;;;+2
InChIKeyWBUNEHCHJUACBF-UHFFFAOYSA-N
MW2302.68 g/mol
LogP29.46
Rot. Bonds17

About 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride

2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride (PubChem CID 159299263) has the molecular formula C93H95Br3F19N21Pt and a molecular weight of 2302.68 g/mol. Its IUPAC name is 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride.

Molecular Properties

Compound Name2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride
PubChem CID159299263
Molecular FormulaC93H95Br3F19N21Pt
Molecular Weight2302.68 g/mol
Exact Mass2298.50
IUPAC Name2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride
SMILESBrc1cccc(Br)n1.C.C.C.CC(C)c1cccc(C(C)C)c1N.CC(C)c1cccc(C(C)C)c1N(c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1)c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1.CC(C)c1cccc(C(C)C)c1N(c1cccc(-n2ccc(C(F)(F)F)n2)n1)c1cccc(-n2ccc(C(F)(F)F)n2)n1.F.FC(F)(F)c1ccn(-c2cccc(Br)n2)n1.FC(F)(F)c1ccn[nH]1.[Pt+2]
InChIInChI=1S/C30H27F6N7.C30H25F6N7.C12H19N.C9H5BrF3N3.C5H3Br2N.C4H3F3N2.3CH4.FH.Pt/c2*1-18(2)20-8-5-9-21(19(3)4)28(20)43(26-12-6-10-24(37-26)41-16-14-22(39-41)29(31,32)33)27-13-7-11-25(38-27)42-17-15-23(40-42)30(34,35)36;1-8(2)10-6-5-7-11(9(3)4)12(10)13;10-7-2-1-3-8(14-7)16-5-4-6(15-16)9(11,12)13;6-4-2-1-3-5(7)8-4;5-4(6,7)3-1-2-8-9-3;;;;;/h5-19H,1-4H3;5-15,18-19H,1-4H3;5-9H,13H2,1-4H3;1-5H;1-3H;1-2H,(H,8,9);3*1H4;1H;/q;-2;;;;;;;;;+2
InChIKeyWBUNEHCHJUACBF-UHFFFAOYSA-N
XLogP29.46
TPSA227.62 Ų
H-Bond Donors2
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms137
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002302.68
LogP ≤ 529.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride 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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride?
The IUPAC name of 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride (CID 159299263) is 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride.
What is the SMILES notation for 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride?
The canonical SMILES for 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride is Brc1cccc(Br)n1.C.C.C.CC(C)c1cccc(C(C)C)c1N.CC(C)c1cccc(C(C)C)c1N(c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1)c1cccc(-n2[c-]cc(C(F)(F)F)n2)n1.CC(C)c1cccc(C(C)C)c1N(c1cccc(-n2ccc(C(F)(F)F)n2)n1)c1cccc(-n2ccc(C(F)(F)F)n2)n1.F.FC(F)(F)c1ccn(-c2cccc(Br)n2)n1.FC(F)(F)c1ccn[nH]1.[Pt+2].
What is the InChIKey of 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride?
The InChIKey is WBUNEHCHJUACBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27F6N7.C30H25F6N7.C12H19N.C9H5BrF3N3.C5H3Br2N.C4H3F3N2.3CH4.FH.Pt/c2*1-18(2)20-8-5-9-21(19(3)4)28(20)43(26-12-6-10-24(37-26)41-16-14-22(39-41)29(31,32)33)27-13-7-11-25(38-27)42-17-15-23(40-42)30(34,35)36;1-8(2)10-6-5-7-11(9(3)4)12(10)13;10-7-2-1-3-8(14-7)16-5-4-6(15-16)9(11,12)13;6-4-2-1-3-5(7)8-4;5-4(6,7)3-1-2-8-9-3;;;;;/h5-19H,1-4H3;5-15,18-19H,1-4H3;5-9H,13H2,1-4H3;1-5H;1-3H;1-2H,(H,8,9);3*1H4;1H;/q;-2;;;;;;;;;+2.
What are the key properties of 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride?
2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride has a molecular weight of 2302.68 g/mol, XLogP of 29.46, 17 rotatable bonds, 2 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine;2,6-dibromopyridine;2,6-di(propan-2-yl)aniline;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-N-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-[2,6-di(propan-2-yl)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-yl]-N-[6-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]pyridin-2-amine;methane;platinum(2+);5-(trifluoromethyl)-1H-pyrazole;hydrofluoride is sourced from PubChem (CID 159299263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).