1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine

C288H196N6 — CID 163898864

IUPAC1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine
SMILESc1ccc(-c2cccc(-c3ccc(N(c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c4)c4ccc5ccc6c(N(c7ccc(-c8cccc(-c9ccccc9)c8)cc7)c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(N(c4cccc(-c5cccc(-c6ccccc6)c5)c4)c4ccc5ccc6c(N(c7ccc(-c8cccc(-c9ccccc9)c8)cc7)c7cccc(-c8cccc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)cc3)c2)cc1.c1ccc(-c2cccc(-c3cccc(N(c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cc4)c4ccc5ccc6c(N(c7ccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)cc7)c7cccc(-c8cccc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)c3)c2)cc1
InChIInChI=1S/2C100H68N2.C88H60N2/c1-7-23-69(24-8-1)79-35-19-37-81(59-79)83-39-21-41-93(67-83)101(91-51-43-75(44-52-91)89-63-85(71-27-11-3-12-28-71)61-86(64-89)72-29-13-4-14-30-72)97-57-49-77-48-56-96-98(58-50-78-47-55-95(97)99(77)100(78)96)102(94-42-22-40-84(68-94)82-38-20-36-80(60-82)70-25-9-2-10-26-70)92-53-45-76(46-54-92)90-65-87(73-31-15-5-16-32-73)62-88(66-90)74-33-17-6-18-34-74;1-7-23-69(24-8-1)79-35-19-37-81(59-79)75-43-51-91(52-44-75)101(93-41-21-39-83(67-93)89-63-85(71-27-11-3-12-28-71)61-86(64-89)72-29-13-4-14-30-72)97-57-49-77-48-56-96-98(58-50-78-47-55-95(97)99(77)100(78)96)102(92-53-45-76(46-54-92)82-38-20-36-80(60-82)70-25-9-2-10-26-70)94-42-22-40-84(68-94)90-65-87(73-31-15-5-16-32-73)62-88(66-90)74-33-17-6-18-34-74;1-5-19-61(20-6-1)69-27-13-31-73(55-69)65-39-47-79(48-40-65)89(81-37-17-35-77(59-81)75-33-15-29-71(57-75)63-23-9-3-10-24-63)85-53-45-67-44-52-84-86(54-46-68-43-51-83(85)87(67)88(68)84)90(80-49-41-66(42-50-80)74-32-14-28-70(56-74)62-21-7-2-8-22-62)82-38-18-36-78(60-82)76-34-16-30-72(58-76)64-25-11-4-12-26-64/h2*1-68H;1-60H
InChIKeyQIASCDBOKVATGG-UHFFFAOYSA-N
MW3740.78 g/mol
LogP81.25
Rot. Bonds46

About 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine

1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine (PubChem CID 163898864) has the molecular formula C288H196N6 and a molecular weight of 3740.78 g/mol. Its IUPAC name is 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine.

Molecular Properties

Compound Name1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine
PubChem CID163898864
Molecular FormulaC288H196N6
Molecular Weight3740.78 g/mol
Exact Mass3737.55
IUPAC Name1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine
SMILESc1ccc(-c2cccc(-c3ccc(N(c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c4)c4ccc5ccc6c(N(c7ccc(-c8cccc(-c9ccccc9)c8)cc7)c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(N(c4cccc(-c5cccc(-c6ccccc6)c5)c4)c4ccc5ccc6c(N(c7ccc(-c8cccc(-c9ccccc9)c8)cc7)c7cccc(-c8cccc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)cc3)c2)cc1.c1ccc(-c2cccc(-c3cccc(N(c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cc4)c4ccc5ccc6c(N(c7ccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)cc7)c7cccc(-c8cccc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)c3)c2)cc1
InChIInChI=1S/2C100H68N2.C88H60N2/c1-7-23-69(24-8-1)79-35-19-37-81(59-79)83-39-21-41-93(67-83)101(91-51-43-75(44-52-91)89-63-85(71-27-11-3-12-28-71)61-86(64-89)72-29-13-4-14-30-72)97-57-49-77-48-56-96-98(58-50-78-47-55-95(97)99(77)100(78)96)102(94-42-22-40-84(68-94)82-38-20-36-80(60-82)70-25-9-2-10-26-70)92-53-45-76(46-54-92)90-65-87(73-31-15-5-16-32-73)62-88(66-90)74-33-17-6-18-34-74;1-7-23-69(24-8-1)79-35-19-37-81(59-79)75-43-51-91(52-44-75)101(93-41-21-39-83(67-93)89-63-85(71-27-11-3-12-28-71)61-86(64-89)72-29-13-4-14-30-72)97-57-49-77-48-56-96-98(58-50-78-47-55-95(97)99(77)100(78)96)102(92-53-45-76(46-54-92)82-38-20-36-80(60-82)70-25-9-2-10-26-70)94-42-22-40-84(68-94)90-65-87(73-31-15-5-16-32-73)62-88(66-90)74-33-17-6-18-34-74;1-5-19-61(20-6-1)69-27-13-31-73(55-69)65-39-47-79(48-40-65)89(81-37-17-35-77(59-81)75-33-15-29-71(57-75)63-23-9-3-10-24-63)85-53-45-67-44-52-84-86(54-46-68-43-51-83(85)87(67)88(68)84)90(80-49-41-66(42-50-80)74-32-14-28-70(56-74)62-21-7-2-8-22-62)82-38-18-36-78(60-82)76-34-16-30-72(58-76)64-25-11-4-12-26-64/h2*1-68H;1-60H
InChIKeyQIASCDBOKVATGG-UHFFFAOYSA-N
XLogP81.25
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds46
Heavy Atoms294
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003740.78
LogP ≤ 581.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine with MolForge

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Related Compounds

1-N,6-N-bis(3,5-diphenylphenyl)-1-N,6-N-bis[4-(2,6-diphenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis(4-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[4-(2,6-diphenylphenyl)phenyl]-1-N,6-N-bis(3-phenylphenyl)pyrene-1,6-diamine
CID 163518435
N,N-bis[4-[4-(N-phenylanilino)phenyl]phenyl]pyren-1-amine
CID 59165153
1-N,6-N-bis[3-(3,5-ditert-butylphenyl)phenyl]-1-N,6-N-bis[4-(3,5-ditert-butylphenyl)phenyl]pyrene-1,6-diamine
CID 162778340
1-N,6-N-bis[3,5-bis(3,5-dimethylphenyl)phenyl]-1-N,6-N-diphenylpyrene-1,6-diamine
CID 58322160
1-N,1-N,6-N,6-N-tetraphenylpyrene-1,6-diamine
CID 23019723
1-N,6-N-bis[3,5-bis(2,6-difluorophenyl)phenyl]-1-N,6-N-diphenylpyrene-1,6-diamine
CID 58322348
6-carbazol-9-yl-N-phenyl-N-[3-(4-phenylphenyl)phenyl]pyren-1-amine
CID 167414887
N-[3-(3,5-diphenylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)naphthalen-1-amine
CID 166974675
N-(3-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaen-7-amine
CID 177100436
1-N-(3-methylphenyl)-1-N,6-N,6-N-triphenylpyrene-1,6-diamine
CID 143254467
N,N-diphenyl-3-[3-[3-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline
CID 118689272
3-[4-(N-phenylanilino)phenyl]-N-[4-[3-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 126502501

Frequently Asked Questions

What is the IUPAC name of 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine?
The IUPAC name of 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine (CID 163898864) is 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine.
What is the SMILES notation for 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine?
The canonical SMILES for 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine is c1ccc(-c2cccc(-c3ccc(N(c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)c4)c4ccc5ccc6c(N(c7ccc(-c8cccc(-c9ccccc9)c8)cc7)c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(N(c4cccc(-c5cccc(-c6ccccc6)c5)c4)c4ccc5ccc6c(N(c7ccc(-c8cccc(-c9ccccc9)c8)cc7)c7cccc(-c8cccc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)cc3)c2)cc1.c1ccc(-c2cccc(-c3cccc(N(c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cc4)c4ccc5ccc6c(N(c7ccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)cc7)c7cccc(-c8cccc(-c9ccccc9)c8)c7)ccc7ccc4c5c76)c3)c2)cc1.
What is the InChIKey of 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine?
The InChIKey is QIASCDBOKVATGG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C100H68N2.C88H60N2/c1-7-23-69(24-8-1)79-35-19-37-81(59-79)83-39-21-41-93(67-83)101(91-51-43-75(44-52-91)89-63-85(71-27-11-3-12-28-71)61-86(64-89)72-29-13-4-14-30-72)97-57-49-77-48-56-96-98(58-50-78-47-55-95(97)99(77)100(78)96)102(94-42-22-40-84(68-94)82-38-20-36-80(60-82)70-25-9-2-10-26-70)92-53-45-76(46-54-92)90-65-87(73-31-15-5-16-32-73)62-88(66-90)74-33-17-6-18-34-74;1-7-23-69(24-8-1)79-35-19-37-81(59-79)75-43-51-91(52-44-75)101(93-41-21-39-83(67-93)89-63-85(71-27-11-3-12-28-71)61-86(64-89)72-29-13-4-14-30-72)97-57-49-77-48-56-96-98(58-50-78-47-55-95(97)99(77)100(78)96)102(92-53-45-76(46-54-92)82-38-20-36-80(60-82)70-25-9-2-10-26-70)94-42-22-40-84(68-94)90-65-87(73-31-15-5-16-32-73)62-88(66-90)74-33-17-6-18-34-74;1-5-19-61(20-6-1)69-27-13-31-73(55-69)65-39-47-79(48-40-65)89(81-37-17-35-77(59-81)75-33-15-29-71(57-75)63-23-9-3-10-24-63)85-53-45-67-44-52-84-86(54-46-68-43-51-83(85)87(67)88(68)84)90(80-49-41-66(42-50-80)74-32-14-28-70(56-74)62-21-7-2-8-22-62)82-38-18-36-78(60-82)76-34-16-30-72(58-76)64-25-11-4-12-26-64/h2*1-68H;1-60H.
What are the key properties of 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine?
1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine has a molecular weight of 3740.78 g/mol, XLogP of 81.25, 46 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,6-N-bis[3-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[4-(3,5-diphenylphenyl)phenyl]-1-N,6-N-bis[3-(3-phenylphenyl)phenyl]pyrene-1,6-diamine;1-N,6-N-bis[3-(3-phenylphenyl)phenyl]-1-N,6-N-bis[4-(3-phenylphenyl)phenyl]pyrene-1,6-diamine is sourced from PubChem (CID 163898864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).