N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine

C187H151N3Si — CID 159189372

IUPACN,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine
SMILESCC(C)(C)c1cc2c(c(C(C)(C)C)c1)C1(c3ccccc3-2)c2ccccc2-c2c(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.Cc1ccc2c(c1)C1(c3cc(C)ccc3-2)c2ccccc2-c2c(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.c1ccc(-c2ccccc2N(c2ccc(-c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1
InChIInChI=1S/C67H49NSi.C63H57N.C57H45N/c1-7-23-52(24-8-1)61-35-20-22-38-66(61)68(56-45-48-63-62-36-19-21-37-64(62)67(65(63)49-56,53-25-9-2-10-26-53)54-27-11-3-12-28-54)55-43-39-50(40-44-55)51-41-46-60(47-42-51)69(57-29-13-4-14-30-57,58-31-15-5-16-32-58)59-33-17-6-18-34-59;1-59(2,3)38-34-47-43-22-13-17-26-50(43)63(58(47)55(35-38)60(4,5)6)51-27-18-14-23-46(51)57-52(63)28-19-29-56(57)64(39-30-32-44-41-20-11-15-24-48(41)61(7,8)53(44)36-39)40-31-33-45-42-21-12-16-25-49(42)62(9,10)54(45)37-40;1-34-22-26-42-43-27-23-35(2)31-52(43)57(51(42)30-34)47-19-12-9-16-44(47)54-48(57)20-13-21-53(54)58(36-24-28-40-38-14-7-10-17-45(38)55(3,4)49(40)32-36)37-25-29-41-39-15-8-11-18-46(39)56(5,6)50(41)33-37/h1-49H;11-37H,1-10H3;7-33H,1-6H3
InChIKeyKNWWGILXMHENSB-UHFFFAOYSA-N
MW2468.37 g/mol
LogP45.67
Rot. Bonds17

About N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine

N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine (PubChem CID 159189372) has the molecular formula C187H151N3Si and a molecular weight of 2468.37 g/mol. Its IUPAC name is N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine
PubChem CID159189372
Molecular FormulaC187H151N3Si
Molecular Weight2468.37 g/mol
Exact Mass2466.17
IUPAC NameN,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine
SMILESCC(C)(C)c1cc2c(c(C(C)(C)C)c1)C1(c3ccccc3-2)c2ccccc2-c2c(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.Cc1ccc2c(c1)C1(c3cc(C)ccc3-2)c2ccccc2-c2c(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.c1ccc(-c2ccccc2N(c2ccc(-c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1
InChIInChI=1S/C67H49NSi.C63H57N.C57H45N/c1-7-23-52(24-8-1)61-35-20-22-38-66(61)68(56-45-48-63-62-36-19-21-37-64(62)67(65(63)49-56,53-25-9-2-10-26-53)54-27-11-3-12-28-54)55-43-39-50(40-44-55)51-41-46-60(47-42-51)69(57-29-13-4-14-30-57,58-31-15-5-16-32-58)59-33-17-6-18-34-59;1-59(2,3)38-34-47-43-22-13-17-26-50(43)63(58(47)55(35-38)60(4,5)6)51-27-18-14-23-46(51)57-52(63)28-19-29-56(57)64(39-30-32-44-41-20-11-15-24-48(41)61(7,8)53(44)36-39)40-31-33-45-42-21-12-16-25-49(42)62(9,10)54(45)37-40;1-34-22-26-42-43-27-23-35(2)31-52(43)57(51(42)30-34)47-19-12-9-16-44(47)54-48(57)20-13-21-53(54)58(36-24-28-40-38-14-7-10-17-45(38)55(3,4)49(40)32-36)37-25-29-41-39-15-8-11-18-46(39)56(5,6)50(41)33-37/h1-49H;11-37H,1-10H3;7-33H,1-6H3
InChIKeyKNWWGILXMHENSB-UHFFFAOYSA-N
XLogP45.67
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms191
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002468.37
LogP ≤ 545.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine?
The IUPAC name of N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine (CID 159189372) is N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine.
What is the SMILES notation for N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine?
The canonical SMILES for N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine is CC(C)(C)c1cc2c(c(C(C)(C)C)c1)C1(c3ccccc3-2)c2ccccc2-c2c(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.Cc1ccc2c(c1)C1(c3cc(C)ccc3-2)c2ccccc2-c2c(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cccc21.c1ccc(-c2ccccc2N(c2ccc(-c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.
What is the InChIKey of N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine?
The InChIKey is KNWWGILXMHENSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H49NSi.C63H57N.C57H45N/c1-7-23-52(24-8-1)61-35-20-22-38-66(61)68(56-45-48-63-62-36-19-21-37-64(62)67(65(63)49-56,53-25-9-2-10-26-53)54-27-11-3-12-28-54)55-43-39-50(40-44-55)51-41-46-60(47-42-51)69(57-29-13-4-14-30-57,58-31-15-5-16-32-58)59-33-17-6-18-34-59;1-59(2,3)38-34-47-43-22-13-17-26-50(43)63(58(47)55(35-38)60(4,5)6)51-27-18-14-23-46(51)57-52(63)28-19-29-56(57)64(39-30-32-44-41-20-11-15-24-48(41)61(7,8)53(44)36-39)40-31-33-45-42-21-12-16-25-49(42)62(9,10)54(45)37-40;1-34-22-26-42-43-27-23-35(2)31-52(43)57(51(42)30-34)47-19-12-9-16-44(47)54-48(57)20-13-21-53(54)58(36-24-28-40-38-14-7-10-17-45(38)55(3,4)49(40)32-36)37-25-29-41-39-15-8-11-18-46(39)56(5,6)50(41)33-37/h1-49H;11-37H,1-10H3;7-33H,1-6H3.
What are the key properties of N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine?
N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine has a molecular weight of 2468.37 g/mol, XLogP of 45.67, 17 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(9,9-dimethylfluoren-2-yl)-2',7'-dimethyl-9,9'-spirobi[fluorene]-4-amine;1',3'-ditert-butyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;9,9-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 159189372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).