N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine

C56H43NO — CID 156550278

IUPACN-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4cccc5c4-c4oc6ccccc6c4C5(C)C)cc3)cc21
InChIInChI=1S/C56H43NO/c1-55(2)48-18-10-8-15-45(48)46-34-33-43(35-50(46)55)57(41-29-25-39(26-30-41)38-23-21-37(22-24-38)36-13-6-5-7-14-36)42-31-27-40(28-32-42)44-17-12-19-49-52(44)54-53(56(49,3)4)47-16-9-11-20-51(47)58-54/h5-35H,1-4H3
InChIKeyRGCYAFUBZMYPOX-UHFFFAOYSA-N
MW745.97 g/mol
LogP15.52
Rot. Bonds6

About N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine

N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 156550278) has the molecular formula C56H43NO and a molecular weight of 745.97 g/mol. Its IUPAC name is N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
PubChem CID156550278
Molecular FormulaC56H43NO
Molecular Weight745.97 g/mol
Exact Mass745.33
IUPAC NameN-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4cccc5c4-c4oc6ccccc6c4C5(C)C)cc3)cc21
InChIInChI=1S/C56H43NO/c1-55(2)48-18-10-8-15-45(48)46-34-33-43(35-50(46)55)57(41-29-25-39(26-30-41)38-23-21-37(22-24-38)36-13-6-5-7-14-36)42-31-27-40(28-32-42)44-17-12-19-49-52(44)54-53(56(49,3)4)47-16-9-11-20-51(47)58-54/h5-35H,1-4H3
InChIKeyRGCYAFUBZMYPOX-UHFFFAOYSA-N
XLogP15.52
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500745.97
LogP ≤ 515.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 156549318
N-(9,9-dimethyl-5-phenylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 177095674
9,9-dimethyl-N-(4-phenylphenyl)-N-[3-[1-(2-phenylphenyl)dibenzofuran-2-yl]phenyl]fluoren-2-amine
CID 177281131
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-dimethylfluoren-2-amine
CID 118146115
N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenylfluoren-2-amine
CID 67964252
N-[2-dibenzofuran-1-yl-3-(4-phenylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 167285876
N-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-4-yl)phenyl]-3-phenyldibenzofuran-1-amine
CID 170722738
N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 67964274
N,N-bis[4-(2,6-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 168771647
9,9-dimethyl-5-phenyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 155153854
7-dibenzofuran-3-yl-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 67964420
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-7-phenylfluoren-2-amine
CID 67964328

Frequently Asked Questions

What is the IUPAC name of N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
The IUPAC name of N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (CID 156550278) is N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.
What is the SMILES notation for N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
The canonical SMILES for N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4cccc5c4-c4oc6ccccc6c4C5(C)C)cc3)cc21.
What is the InChIKey of N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
The InChIKey is RGCYAFUBZMYPOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H43NO/c1-55(2)48-18-10-8-15-45(48)46-34-33-43(35-50(46)55)57(41-29-25-39(26-30-41)38-23-21-37(22-24-38)36-13-6-5-7-14-36)42-31-27-40(28-32-42)44-17-12-19-49-52(44)54-53(56(49,3)4)47-16-9-11-20-51(47)58-54/h5-35H,1-4H3.
What are the key properties of N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine has a molecular weight of 745.97 g/mol, XLogP of 15.52, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(10,10-dimethylindeno[1,2-b][1]benzofuran-4-yl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 156550278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).