2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine

C187H181N3 — CID 160813603

IUPAC2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
SMILESCC(C)(C)Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C2(c4ccccc4-3)c3cc(C(C)(C)C)ccc3-c3ccc(C(C)(C)C)cc32)cc1.CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5C(C)(C)C)cc4)c4ccc5c(c4)-c4ccccc4C5(C)C)cc31)c1cc(C(C)(C)C)ccc1-2.CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc4-c4ccccc4C(C)(C)C)cc31)c1cc(C(C)(C)C)ccc1-2
InChIInChI=1S/2C64H61N.C59H59N/c1-60(2,3)40-28-32-48-49-33-29-41(61(4,5)6)37-57(49)64(56(48)36-40)54-26-18-14-21-45(54)50-35-31-43(39-58(50)64)65(42-30-34-47-44-20-13-17-25-53(44)63(10,11)55(47)38-42)59-27-19-15-23-51(59)46-22-12-16-24-52(46)62(7,8)9;1-60(2,3)41-26-32-49-50-33-27-42(61(4,5)6)37-58(50)64(57(49)36-41)56-23-17-14-19-47(56)51-34-30-45(39-59(51)64)65(43-28-24-40(25-29-43)46-18-12-15-21-53(46)62(7,8)9)44-31-35-55-52(38-44)48-20-13-16-22-54(48)63(55,10)11;1-55(2,3)36-37-20-24-40(25-21-37)60(41-26-30-45-43-16-12-14-18-49(43)58(10,11)51(45)34-41)42-27-31-48-44-17-13-15-19-50(44)59(54(48)35-42)52-32-38(56(4,5)6)22-28-46(52)47-29-23-39(33-53(47)59)57(7,8)9/h2*12-39H,1-11H3;12-35H,36H2,1-11H3
InChIKeySEPRMWHVBHFYFF-UHFFFAOYSA-N
MW2470.53 g/mol
LogP50.72
Rot. Bonds12

About 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine

2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine (PubChem CID 160813603) has the molecular formula C187H181N3 and a molecular weight of 2470.53 g/mol. Its IUPAC name is 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine.

Molecular Properties

Compound Name2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
PubChem CID160813603
Molecular FormulaC187H181N3
Molecular Weight2470.53 g/mol
Exact Mass2468.43
IUPAC Name2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
SMILESCC(C)(C)Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C2(c4ccccc4-3)c3cc(C(C)(C)C)ccc3-c3ccc(C(C)(C)C)cc32)cc1.CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5C(C)(C)C)cc4)c4ccc5c(c4)-c4ccccc4C5(C)C)cc31)c1cc(C(C)(C)C)ccc1-2.CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc4-c4ccccc4C(C)(C)C)cc31)c1cc(C(C)(C)C)ccc1-2
InChIInChI=1S/2C64H61N.C59H59N/c1-60(2,3)40-28-32-48-49-33-29-41(61(4,5)6)37-57(49)64(56(48)36-40)54-26-18-14-21-45(54)50-35-31-43(39-58(50)64)65(42-30-34-47-44-20-13-17-25-53(44)63(10,11)55(47)38-42)59-27-19-15-23-51(59)46-22-12-16-24-52(46)62(7,8)9;1-60(2,3)41-26-32-49-50-33-27-42(61(4,5)6)37-58(50)64(57(49)36-41)56-23-17-14-19-47(56)51-34-30-45(39-59(51)64)65(43-28-24-40(25-29-43)46-18-12-15-21-53(46)62(7,8)9)44-31-35-55-52(38-44)48-20-13-16-22-54(48)63(55,10)11;1-55(2,3)36-37-20-24-40(25-21-37)60(41-26-30-45-43-16-12-14-18-49(43)58(10,11)51(45)34-41)42-27-31-48-44-17-13-15-19-50(44)59(54(48)35-42)52-32-38(56(4,5)6)22-28-46(52)47-29-23-39(33-53(47)59)57(7,8)9/h2*12-39H,1-11H3;12-35H,36H2,1-11H3
InChIKeySEPRMWHVBHFYFF-UHFFFAOYSA-N
XLogP50.72
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms190
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002470.53
LogP ≤ 550.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine with MolForge

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Related Compounds

2',7'-ditert-butyl-N-(9,9-dimethylfluoren-3-yl)-N-[2-[4-(1,1,1-trideuterio-2-methylpropan-2-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 157470286
3,6-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9,9'-spirobi[fluorene]-2'-amine
CID 170215490
2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2-methylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 177124718
N-[2-(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-2-yl)phenyl]-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-3-amine
CID 170142627
N-[4-(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-1-yl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 142508836
2',7'-ditert-butyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 162363447
2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine
CID 153307449
2',7'-ditert-butyl-N-[2-(7-tert-butyl-9,9-dimethylfluoren-4-yl)phenyl]-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 170141214
N-[4-(2',7'-ditert-butyl-9,9'-spirobi[fluorene]-2-yl)phenyl]-2-(9,9-dimethylfluoren-4-yl)-N-[3-(9,9-dimethylfluoren-3-yl)phenyl]aniline
CID 170142560
5-tert-butyl-2-N'-(9,9-dimethylfluoren-3-yl)-2-N,2-N,2-N',3-tetraphenyl-9,9'-spirobi[fluorene]-2,2'-diamine
CID 168791853
bis(N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine);N-(9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine
CID 161294273
2',7'-ditert-butyl-N-(9,9-dimethylfluoren-1-yl)-N-[3-(4-ethylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-3-yl)-N-[2-(4-ethylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-4-yl)-N-[2-(4-ethylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-4-yl)-N-[4-(3-ethylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 158841600

Frequently Asked Questions

What is the IUPAC name of 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine?
The IUPAC name of 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine (CID 160813603) is 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine.
What is the SMILES notation for 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine?
The canonical SMILES for 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine is CC(C)(C)Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C2(c4ccccc4-3)c3cc(C(C)(C)C)ccc3-c3ccc(C(C)(C)C)cc32)cc1.CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5C(C)(C)C)cc4)c4ccc5c(c4)-c4ccccc4C5(C)C)cc31)c1cc(C(C)(C)C)ccc1-2.CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc4-c4ccccc4C(C)(C)C)cc31)c1cc(C(C)(C)C)ccc1-2.
What is the InChIKey of 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine?
The InChIKey is SEPRMWHVBHFYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C64H61N.C59H59N/c1-60(2,3)40-28-32-48-49-33-29-41(61(4,5)6)37-57(49)64(56(48)36-40)54-26-18-14-21-45(54)50-35-31-43(39-58(50)64)65(42-30-34-47-44-20-13-17-25-53(44)63(10,11)55(47)38-42)59-27-19-15-23-51(59)46-22-12-16-24-52(46)62(7,8)9;1-60(2,3)41-26-32-49-50-33-27-42(61(4,5)6)37-58(50)64(57(49)36-41)56-23-17-14-19-47(56)51-34-30-45(39-59(51)64)65(43-28-24-40(25-29-43)46-18-12-15-21-53(46)62(7,8)9)44-31-35-55-52(38-44)48-20-13-16-22-54(48)63(55,10)11;1-55(2,3)36-37-20-24-40(25-21-37)60(41-26-30-45-43-16-12-14-18-49(43)58(10,11)51(45)34-41)42-27-31-48-44-17-13-15-19-50(44)59(54(48)35-42)52-32-38(56(4,5)6)22-28-46(52)47-29-23-39(33-53(47)59)57(7,8)9/h2*12-39H,1-11H3;12-35H,36H2,1-11H3.
What are the key properties of 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine?
2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine has a molecular weight of 2470.53 g/mol, XLogP of 50.72, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2',7'-ditert-butyl-N-[2-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-[4-(2-tert-butylphenyl)phenyl]-N-(9,9-dimethylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;2',7'-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-N-[4-(2,2-dimethylpropyl)phenyl]-9,9'-spirobi[fluorene]-2-amine is sourced from PubChem (CID 160813603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).