2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)

C69H46F7Ir4N6O2-5 — CID 159404145

IUPAC2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)
SMILESFc1c[c-]c(-c2cc(N(c3ccccc3)c3ccccc3)ccn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)cc1.OCc1ccnc(-c2[c-]cc(F)cc2)c1.OCc1ccnc(-c2[c-]cc(F)cc2F)c1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C23H16FN2.C12H8F2NO.C12H9FNO.C11H6F2N.C11H7FN.4Ir/c24-19-13-11-18(12-14-19)23-17-22(15-16-25-23)26(20-7-3-1-4-8-20)21-9-5-2-6-10-21;13-9-1-2-10(11(14)6-9)12-5-8(7-16)3-4-15-12;13-11-3-1-10(2-4-11)12-7-9(8-15)5-6-14-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;12-10-6-4-9(5-7-10)11-3-1-2-8-13-11;;;;/h1-11,13-17H;1,3-6,16H,7H2;1,3-7,15H,8H2;1-4,6-7H;1-4,6-8H;;;;/q5*-1;;;;
InChIKeyXFPREPGAAXIGIC-UHFFFAOYSA-N
MW1893.02 g/mol
LogP16.16
Rot. Bonds10

About 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)

2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium) (PubChem CID 159404145) has the molecular formula C69H46F7Ir4N6O2-5 and a molecular weight of 1893.02 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium).

Molecular Properties

Compound Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)
PubChem CID159404145
Molecular FormulaC69H46F7Ir4N6O2-5
Molecular Weight1893.02 g/mol
Exact Mass1895.21
IUPAC Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)
SMILESFc1c[c-]c(-c2cc(N(c3ccccc3)c3ccccc3)ccn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)cc1.OCc1ccnc(-c2[c-]cc(F)cc2)c1.OCc1ccnc(-c2[c-]cc(F)cc2F)c1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C23H16FN2.C12H8F2NO.C12H9FNO.C11H6F2N.C11H7FN.4Ir/c24-19-13-11-18(12-14-19)23-17-22(15-16-25-23)26(20-7-3-1-4-8-20)21-9-5-2-6-10-21;13-9-1-2-10(11(14)6-9)12-5-8(7-16)3-4-15-12;13-11-3-1-10(2-4-11)12-7-9(8-15)5-6-14-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;12-10-6-4-9(5-7-10)11-3-1-2-8-13-11;;;;/h1-11,13-17H;1,3-6,16H,7H2;1,3-7,15H,8H2;1-4,6-7H;1-4,6-8H;;;;/q5*-1;;;;
InChIKeyXFPREPGAAXIGIC-UHFFFAOYSA-N
XLogP16.16
TPSA108.15 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms88
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001893.02
LogP ≤ 516.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium) 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-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)?
The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium) (CID 159404145) is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium).
What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)?
The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium) is Fc1c[c-]c(-c2cc(N(c3ccccc3)c3ccccc3)ccn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)cc1.OCc1ccnc(-c2[c-]cc(F)cc2)c1.OCc1ccnc(-c2[c-]cc(F)cc2F)c1.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)?
The InChIKey is XFPREPGAAXIGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16FN2.C12H8F2NO.C12H9FNO.C11H6F2N.C11H7FN.4Ir/c24-19-13-11-18(12-14-19)23-17-22(15-16-25-23)26(20-7-3-1-4-8-20)21-9-5-2-6-10-21;13-9-1-2-10(11(14)6-9)12-5-8(7-16)3-4-15-12;13-11-3-1-10(2-4-11)12-7-9(8-15)5-6-14-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;12-10-6-4-9(5-7-10)11-3-1-2-8-13-11;;;;/h1-11,13-17H;1,3-6,16H,7H2;1,3-7,15H,8H2;1-4,6-7H;1-4,6-8H;;;;/q5*-1;;;;.
What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium)?
2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium) has a molecular weight of 1893.02 g/mol, XLogP of 16.16, 10 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;[2-(2,4-difluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;2-(4-fluorobenzene-6-id-1-yl)-N,N-diphenylpyridin-4-amine;2-(4-fluorobenzene-6-id-1-yl)pyridine;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanol;tetrakis(iridium) is sourced from PubChem (CID 159404145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).