N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))

C130H96F5N9Pt3 — CID 163543340

IUPACN,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))
SMILESCC(C)(C)c1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(C(C)(C)C)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Cc1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(C(F)(F)F)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Fc1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(F)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C48H43N3.C42H28F3N3.C40H25F2N3.3Pt/c1-47(2,3)38-26-28-49-44(32-38)36-20-13-22-40(30-36)51(41-23-14-21-37(31-41)45-33-39(27-29-50-45)48(4,5)6)46-42(34-16-9-7-10-17-34)24-15-25-43(46)35-18-11-8-12-19-35;1-29-21-23-46-39(25-29)32-15-8-17-35(26-32)48(36-18-9-16-33(27-36)40-28-34(22-24-47-40)42(43,44)45)41-37(30-11-4-2-5-12-30)19-10-20-38(41)31-13-6-3-7-14-31;41-32-20-22-43-38(26-32)30-14-7-16-34(24-30)45(35-17-8-15-31(25-35)39-27-33(42)21-23-44-39)40-36(28-10-3-1-4-11-28)18-9-19-37(40)29-12-5-2-6-13-29;;;/h7-29,32-33H,1-6H3;2-25,28H,1H3;1-23,26-27H;;;/q3*-2;3*+2
InChIKeyKWPFTFBCHKNEEM-UHFFFAOYSA-N
MW2464.48 g/mol
LogP34.84
Rot. Bonds21

About N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))

N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)) (PubChem CID 163543340) has the molecular formula C130H96F5N9Pt3 and a molecular weight of 2464.48 g/mol. Its IUPAC name is N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)).

Molecular Properties

Compound NameN,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))
PubChem CID163543340
Molecular FormulaC130H96F5N9Pt3
Molecular Weight2464.48 g/mol
Exact Mass2462.67
IUPAC NameN,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))
SMILESCC(C)(C)c1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(C(C)(C)C)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Cc1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(C(F)(F)F)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Fc1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(F)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C48H43N3.C42H28F3N3.C40H25F2N3.3Pt/c1-47(2,3)38-26-28-49-44(32-38)36-20-13-22-40(30-36)51(41-23-14-21-37(31-41)45-33-39(27-29-50-45)48(4,5)6)46-42(34-16-9-7-10-17-34)24-15-25-43(46)35-18-11-8-12-19-35;1-29-21-23-46-39(25-29)32-15-8-17-35(26-32)48(36-18-9-16-33(27-36)40-28-34(22-24-47-40)42(43,44)45)41-37(30-11-4-2-5-12-30)19-10-20-38(41)31-13-6-3-7-14-31;41-32-20-22-43-38(26-32)30-14-7-16-34(24-30)45(35-17-8-15-31(25-35)39-27-33(42)21-23-44-39)40-36(28-10-3-1-4-11-28)18-9-19-37(40)29-12-5-2-6-13-29;;;/h7-29,32-33H,1-6H3;2-25,28H,1H3;1-23,26-27H;;;/q3*-2;3*+2
InChIKeyKWPFTFBCHKNEEM-UHFFFAOYSA-N
XLogP34.84
TPSA87.06 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds21
Heavy Atoms147
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002464.48
LogP ≤ 534.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)) with MolForge

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Related Compounds

1-[3,5-Bis[[4-[1-[[3,5-bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phenyl]-4-[1-[3,5-bis[[4-[1-[[3,5-bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phenyl]pyridin-1-ium-4-yl]pyridin-1-ium hexacosahexafluorophosphate
CID 46889635
Tris(2-pyridin-2-ylpyridine);ruthenium(2+);bis(tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide)
CID 72192756
bis(manganese(2+));(2-methylphenyl)-[4-(2-methylphenyl)azanidyl-3,6-bis[(2-methylphenyl)imino]cyclohexa-1,4-dien-1-yl]azanide;bis(1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine);bis(tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide)
CID 139046353
CID 139137964
CID 139137964
6,6',6'',6'''-([1,1':3',1'':3'',1'''-Quaterphenyl]-2,2',2'',2'''-tetrayl)tetrakis(3-fluoropyridine)
CID 155908938
4-Tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;bis(2-(2,4-difluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine);iridium(3+);tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide
CID 166444863
5,11,17-Tris[4,6-bis(trifluoromethyl)-3-pyridinyl]-8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
CID 168327420
1,3,5-Tris(6-(3-(pyridin-3-yl)phenyl)pyridin-2-yl)benzene
CID 102128661
Platinum(2+);3-pyridin-2-yl-6-[2-[5-pyridin-2-yl-6-[3-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]-2-[3-(trifluoromethyl)benzene-6-id-1-yl]pyridine
CID 57739647
Manganese(2+);5,10,15-tris(1-ethylpyridin-1-ium-3-yl)-20-[1-(2,2,2-trifluoroethyl)pyridin-1-ium-3-yl]porphyrin-22,24-diide
CID 58503618
2-[2-[3,5-Bis[2-(6-pyridin-2-ylpyridin-2-yl)phenyl]phenyl]phenyl]-5-(trifluoromethyl)pyridine
CID 71127808
5,10,15,20-Tetrakis(2,3,5,6-tetrafluoro-4-pyridin-2-ylphenyl)porphyrin
CID 88038683

Frequently Asked Questions

What is the IUPAC name of N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))?
The IUPAC name of N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)) (CID 163543340) is N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)).
What is the SMILES notation for N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))?
The canonical SMILES for N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)) is CC(C)(C)c1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(C(C)(C)C)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Cc1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(C(F)(F)F)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.Fc1ccnc(-c2[c-]c(N(c3[c-]c(-c4cc(F)ccn4)ccc3)c3c(-c4ccccc4)cccc3-c3ccccc3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))?
The InChIKey is KWPFTFBCHKNEEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H43N3.C42H28F3N3.C40H25F2N3.3Pt/c1-47(2,3)38-26-28-49-44(32-38)36-20-13-22-40(30-36)51(41-23-14-21-37(31-41)45-33-39(27-29-50-45)48(4,5)6)46-42(34-16-9-7-10-17-34)24-15-25-43(46)35-18-11-8-12-19-35;1-29-21-23-46-39(25-29)32-15-8-17-35(26-32)48(36-18-9-16-33(27-36)40-28-34(22-24-47-40)42(43,44)45)41-37(30-11-4-2-5-12-30)19-10-20-38(41)31-13-6-3-7-14-31;41-32-20-22-43-38(26-32)30-14-7-16-34(24-30)45(35-17-8-15-31(25-35)39-27-33(42)21-23-44-39)40-36(28-10-3-1-4-11-28)18-9-19-37(40)29-12-5-2-6-13-29;;;/h7-29,32-33H,1-6H3;2-25,28H,1H3;1-23,26-27H;;;/q3*-2;3*+2.
What are the key properties of N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+))?
N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)) has a molecular weight of 2464.48 g/mol, XLogP of 34.84, 21 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N,N-bis[3-(4-fluoro-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenylaniline;N-[3-(4-methyl-2-pyridinyl)benzene-2-id-1-yl]-2,6-diphenyl-N-[3-[4-(trifluoromethyl)-2-pyridinyl]benzene-2-id-1-yl]aniline;tris(platinum(2+)) is sourced from PubChem (CID 163543340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).