N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine

C174H136N4 — CID 158817105

IUPACN-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine
SMILESCC1(C)CC(C)(c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2cccc(C3(C)CC(C)(C)c4cc(N(c5ccc(C)cc5)c5ccc(-c6ccccc6)cc5)ccc43)c2)cc1
InChIInChI=1S/C118H86N2.C56H50N2/c1-113(2)79-114(3,88-53-36-54-89(73-88)119(90-63-68-99-95-55-28-32-59-103(95)115(108(99)74-90,80-37-12-4-13-38-80)81-39-14-5-15-40-81)91-64-69-100-96-56-29-33-60-104(96)116(109(100)75-91,82-41-16-6-17-42-82)83-43-18-7-19-44-83)107-72-67-94(78-112(107)113)120(92-65-70-101-97-57-30-34-61-105(97)117(110(101)76-92,84-45-20-8-21-46-84)85-47-22-9-23-48-85)93-66-71-102-98-58-31-35-62-106(98)118(111(102)77-93,86-49-24-10-25-50-86)87-51-26-11-27-52-87;1-40-19-27-47(28-20-40)57(49-31-23-44(24-32-49)42-13-8-6-9-14-42)51-18-12-17-46(37-51)56(5)39-55(3,4)54-38-52(35-36-53(54)56)58(48-29-21-41(2)22-30-48)50-33-25-45(26-34-50)43-15-10-7-11-16-43/h4-78H,79H2,1-3H3;6-38H,39H2,1-5H3
InChIKeyIVKCWCLWVLTQFS-UHFFFAOYSA-N
MW2283.03 g/mol
LogP44.63
Rot. Bonds24

About N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine

N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine (PubChem CID 158817105) has the molecular formula C174H136N4 and a molecular weight of 2283.03 g/mol. Its IUPAC name is N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine.

Molecular Properties

Compound NameN-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine
PubChem CID158817105
Molecular FormulaC174H136N4
Molecular Weight2283.03 g/mol
Exact Mass2281.08
IUPAC NameN-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine
SMILESCC1(C)CC(C)(c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2cccc(C3(C)CC(C)(C)c4cc(N(c5ccc(C)cc5)c5ccc(-c6ccccc6)cc5)ccc43)c2)cc1
InChIInChI=1S/C118H86N2.C56H50N2/c1-113(2)79-114(3,88-53-36-54-89(73-88)119(90-63-68-99-95-55-28-32-59-103(95)115(108(99)74-90,80-37-12-4-13-38-80)81-39-14-5-15-40-81)91-64-69-100-96-56-29-33-60-104(96)116(109(100)75-91,82-41-16-6-17-42-82)83-43-18-7-19-44-83)107-72-67-94(78-112(107)113)120(92-65-70-101-97-57-30-34-61-105(97)117(110(101)76-92,84-45-20-8-21-46-84)85-47-22-9-23-48-85)93-66-71-102-98-58-31-35-62-106(98)118(111(102)77-93,86-49-24-10-25-50-86)87-51-26-11-27-52-87;1-40-19-27-47(28-20-40)57(49-31-23-44(24-32-49)42-13-8-6-9-14-42)51-18-12-17-46(37-51)56(5)39-55(3,4)54-38-52(35-36-53(54)56)58(48-29-21-41(2)22-30-48)50-33-25-45(26-34-50)43-15-10-7-11-16-43/h4-78H,79H2,1-3H3;6-38H,39H2,1-5H3
InChIKeyIVKCWCLWVLTQFS-UHFFFAOYSA-N
XLogP44.63
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds24
Heavy Atoms178
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002283.03
LogP ≤ 544.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine?
The IUPAC name of N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine (CID 158817105) is N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine.
What is the SMILES notation for N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine?
The canonical SMILES for N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine is CC1(C)CC(C)(c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2cccc(C3(C)CC(C)(C)c4cc(N(c5ccc(C)cc5)c5ccc(-c6ccccc6)cc5)ccc43)c2)cc1.
What is the InChIKey of N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine?
The InChIKey is IVKCWCLWVLTQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C118H86N2.C56H50N2/c1-113(2)79-114(3,88-53-36-54-89(73-88)119(90-63-68-99-95-55-28-32-59-103(95)115(108(99)74-90,80-37-12-4-13-38-80)81-39-14-5-15-40-81)91-64-69-100-96-56-29-33-60-104(96)116(109(100)75-91,82-41-16-6-17-42-82)83-43-18-7-19-44-83)107-72-67-94(78-112(107)113)120(92-65-70-101-97-57-30-34-61-105(97)117(110(101)76-92,84-45-20-8-21-46-84)85-47-22-9-23-48-85)93-66-71-102-98-58-31-35-62-106(98)118(111(102)77-93,86-49-24-10-25-50-86)87-51-26-11-27-52-87;1-40-19-27-47(28-20-40)57(49-31-23-44(24-32-49)42-13-8-6-9-14-42)51-18-12-17-46(37-51)56(5)39-55(3,4)54-38-52(35-36-53(54)56)58(48-29-21-41(2)22-30-48)50-33-25-45(26-34-50)43-15-10-7-11-16-43/h4-78H,79H2,1-3H3;6-38H,39H2,1-5H3.
What are the key properties of N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine?
N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine has a molecular weight of 2283.03 g/mol, XLogP of 44.63, 24 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-[bis(9,9-diphenylfluoren-2-yl)amino]phenyl]-1,3,3-trimethyl-2H-inden-5-yl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;1,3,3-trimethyl-N-(4-methylphenyl)-1-[3-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N-(4-phenylphenyl)-2H-inden-5-amine is sourced from PubChem (CID 158817105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).