N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine

C249H222N4 — CID 161274556

IUPACN-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c(-c4ccccc4)cc(-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3-c3ccccc3)cc21.Cc1cc(-c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc(C)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1cc(-c2ccccc2)ccc1N(c1ccc2c(c1)C(C)(C)c1cc(C34CC5CC(CC(C5)C3)C4)ccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1cc(C23CC4CC(CC(C4)C2)C3)cc(C)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2
InChIInChI=1S/2C64H57N.C63H55N.C58H53N/c1-62(2)57-21-13-11-19-51(57)53-29-27-49(36-59(53)62)65(50-28-30-54-52-20-12-14-22-58(52)63(3,4)60(54)37-50)61-55(45-15-7-5-8-16-45)34-47(35-56(61)46-17-9-6-10-18-46)44-23-25-48(26-24-44)64-38-41-31-42(39-64)33-43(32-41)40-64;1-41-31-47(46-23-25-48(26-24-46)63-38-43-33-44(39-63)35-45(34-43)40-63)32-42(2)61(41)65(51-27-29-55-53-19-11-13-21-57(53)62(3,4)59(55)36-51)52-28-30-56-54-20-12-14-22-58(54)64(60(56)37-52,49-15-7-5-8-16-49)50-17-9-6-10-18-50;1-41-31-46(45-15-7-4-8-16-45)23-30-60(41)64(51-26-29-55-52-21-13-14-22-56(52)63(59(55)37-51,47-17-9-5-10-18-47)48-19-11-6-12-20-48)50-25-28-54-53-27-24-49(35-57(53)61(2,3)58(54)36-50)62-38-42-32-43(39-62)34-44(33-42)40-62;1-37-27-44(57-34-39-29-40(35-57)31-41(30-39)36-57)28-38(2)55(37)59(45-23-25-49-47-19-11-13-21-51(47)56(3,4)53(49)32-45)46-24-26-50-48-20-12-14-22-52(48)58(54(50)33-46,42-15-7-5-8-16-42)43-17-9-6-10-18-43/h5-30,34-37,41-43H,31-33,38-40H2,1-4H3;5-32,36-37,43-45H,33-35,38-40H2,1-4H3;4-31,35-37,42-44H,32-34,38-40H2,1-3H3;5-28,32-33,39-41H,29-31,34-36H2,1-4H3
InChIKeyVEGMHJLBESHDJD-UHFFFAOYSA-N
MW3270.54 g/mol
LogP64.99
Rot. Bonds27

About N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine

N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (PubChem CID 161274556) has the molecular formula C249H222N4 and a molecular weight of 3270.54 g/mol. Its IUPAC name is N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
PubChem CID161274556
Molecular FormulaC249H222N4
Molecular Weight3270.54 g/mol
Exact Mass3267.75
IUPAC NameN-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c(-c4ccccc4)cc(-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3-c3ccccc3)cc21.Cc1cc(-c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc(C)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1cc(-c2ccccc2)ccc1N(c1ccc2c(c1)C(C)(C)c1cc(C34CC5CC(CC(C5)C3)C4)ccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1cc(C23CC4CC(CC(C4)C2)C3)cc(C)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2
InChIInChI=1S/2C64H57N.C63H55N.C58H53N/c1-62(2)57-21-13-11-19-51(57)53-29-27-49(36-59(53)62)65(50-28-30-54-52-20-12-14-22-58(52)63(3,4)60(54)37-50)61-55(45-15-7-5-8-16-45)34-47(35-56(61)46-17-9-6-10-18-46)44-23-25-48(26-24-44)64-38-41-31-42(39-64)33-43(32-41)40-64;1-41-31-47(46-23-25-48(26-24-46)63-38-43-33-44(39-63)35-45(34-43)40-63)32-42(2)61(41)65(51-27-29-55-53-19-11-13-21-57(53)62(3,4)59(55)36-51)52-28-30-56-54-20-12-14-22-58(54)64(60(56)37-52,49-15-7-5-8-16-49)50-17-9-6-10-18-50;1-41-31-46(45-15-7-4-8-16-45)23-30-60(41)64(51-26-29-55-52-21-13-14-22-56(52)63(59(55)37-51,47-17-9-5-10-18-47)48-19-11-6-12-20-48)50-25-28-54-53-27-24-49(35-57(53)61(2,3)58(54)36-50)62-38-42-32-43(39-62)34-44(33-42)40-62;1-37-27-44(57-34-39-29-40(35-57)31-41(30-39)36-57)28-38(2)55(37)59(45-23-25-49-47-19-11-13-21-51(47)56(3,4)53(49)32-45)46-24-26-50-48-20-12-14-22-52(48)58(54(50)33-46,42-15-7-5-8-16-42)43-17-9-6-10-18-43/h5-30,34-37,41-43H,31-33,38-40H2,1-4H3;5-32,36-37,43-45H,33-35,38-40H2,1-4H3;4-31,35-37,42-44H,32-34,38-40H2,1-3H3;5-28,32-33,39-41H,29-31,34-36H2,1-4H3
InChIKeyVEGMHJLBESHDJD-UHFFFAOYSA-N
XLogP64.99
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds27
Heavy Atoms253
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003270.54
LogP ≤ 564.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (CID 161274556) is N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3c(-c4ccccc4)cc(-c4ccc(C56CC7CC(CC(C7)C5)C6)cc4)cc3-c3ccccc3)cc21.Cc1cc(-c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc(C)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1cc(-c2ccccc2)ccc1N(c1ccc2c(c1)C(C)(C)c1cc(C34CC5CC(CC(C5)C3)C4)ccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.Cc1cc(C23CC4CC(CC(C4)C2)C3)cc(C)c1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.
What is the InChIKey of N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
The InChIKey is VEGMHJLBESHDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C64H57N.C63H55N.C58H53N/c1-62(2)57-21-13-11-19-51(57)53-29-27-49(36-59(53)62)65(50-28-30-54-52-20-12-14-22-58(52)63(3,4)60(54)37-50)61-55(45-15-7-5-8-16-45)34-47(35-56(61)46-17-9-6-10-18-46)44-23-25-48(26-24-44)64-38-41-31-42(39-64)33-43(32-41)40-64;1-41-31-47(46-23-25-48(26-24-46)63-38-43-33-44(39-63)35-45(34-43)40-63)32-42(2)61(41)65(51-27-29-55-53-19-11-13-21-57(53)62(3,4)59(55)36-51)52-28-30-56-54-20-12-14-22-58(54)64(60(56)37-52,49-15-7-5-8-16-49)50-17-9-6-10-18-50;1-41-31-46(45-15-7-4-8-16-45)23-30-60(41)64(51-26-29-55-52-21-13-14-22-56(52)63(59(55)37-51,47-17-9-5-10-18-47)48-19-11-6-12-20-48)50-25-28-54-53-27-24-49(35-57(53)61(2,3)58(54)36-50)62-38-42-32-43(39-62)34-44(33-42)40-62;1-37-27-44(57-34-39-29-40(35-57)31-41(30-39)36-57)28-38(2)55(37)59(45-23-25-49-47-19-11-13-21-51(47)56(3,4)53(49)32-45)46-24-26-50-48-20-12-14-22-52(48)58(54(50)33-46,42-15-7-5-8-16-42)43-17-9-6-10-18-43/h5-30,34-37,41-43H,31-33,38-40H2,1-4H3;5-32,36-37,43-45H,33-35,38-40H2,1-4H3;4-31,35-37,42-44H,32-34,38-40H2,1-3H3;5-28,32-33,39-41H,29-31,34-36H2,1-4H3.
What are the key properties of N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?
N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine has a molecular weight of 3270.54 g/mol, XLogP of 64.99, 27 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-adamantyl)-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-(1-adamantyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-dimethylphenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[4-[4-(1-adamantyl)phenyl]-2,6-diphenylphenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 161274556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).