N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine

C109H72N2O — CID 137492501

IUPACN-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4cccc(-c5cccc6c5oc5cc(-c7ccc8c9ccccc9c9cc(N(c%10ccc(-c%11ccccc%11)cc%10)c%10ccc%11c(c%10)C(c%10ccccc%10)(c%10ccccc%10)c%10ccccc%10-%11)ccc9c8c7)ccc56)c4)cc3)cc2)cc1
InChIInChI=1S/C109H72N2O/c1-6-22-73(23-7-1)76-40-44-78(45-41-76)81-50-56-88(57-51-81)110(89-58-52-82(53-59-89)79-46-42-77(43-47-79)74-24-8-2-9-25-74)91-33-20-28-85(68-91)94-37-21-38-102-101-65-55-84(70-107(101)112-108(94)102)83-54-64-97-95-34-16-17-35-96(95)104-71-92(62-66-98(104)103(97)69-83)111(90-60-48-80(49-61-90)75-26-10-3-11-27-75)93-63-67-100-99-36-18-19-39-105(99)109(106(100)72-93,86-29-12-4-13-30-86)87-31-14-5-15-32-87/h1-72H
InChIKeyAITTXGVDWISNEY-UHFFFAOYSA-N
MW1425.79 g/mol
LogP30.02
Rot. Bonds15

About N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine

N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine (PubChem CID 137492501) has the molecular formula C109H72N2O and a molecular weight of 1425.79 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine
PubChem CID137492501
Molecular FormulaC109H72N2O
Molecular Weight1425.79 g/mol
Exact Mass1424.56
IUPAC NameN-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4cccc(-c5cccc6c5oc5cc(-c7ccc8c9ccccc9c9cc(N(c%10ccc(-c%11ccccc%11)cc%10)c%10ccc%11c(c%10)C(c%10ccccc%10)(c%10ccccc%10)c%10ccccc%10-%11)ccc9c8c7)ccc56)c4)cc3)cc2)cc1
InChIInChI=1S/C109H72N2O/c1-6-22-73(23-7-1)76-40-44-78(45-41-76)81-50-56-88(57-51-81)110(89-58-52-82(53-59-89)79-46-42-77(43-47-79)74-24-8-2-9-25-74)91-33-20-28-85(68-91)94-37-21-38-102-101-65-55-84(70-107(101)112-108(94)102)83-54-64-97-95-34-16-17-35-96(95)104-71-92(62-66-98(104)103(97)69-83)111(90-60-48-80(49-61-90)75-26-10-3-11-27-75)93-63-67-100-99-36-18-19-39-105(99)109(106(100)72-93,86-29-12-4-13-30-86)87-31-14-5-15-32-87/h1-72H
InChIKeyAITTXGVDWISNEY-UHFFFAOYSA-N
XLogP30.02
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms112
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001425.79
LogP ≤ 530.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine with MolForge

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Related Compounds

N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[3-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[3-(3-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 161367411
3-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 121381580
N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(2-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 158287693
N-[4-[3,5-di(dibenzofuran-4-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 121383311
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N,4-diphenylaniline
CID 164769137
N-(3-dibenzofuran-4-ylphenyl)-3-[4-(9,9-diphenylfluoren-3-yl)phenyl]-N-phenylaniline
CID 168839908
N,9,9-triphenyl-N-[4-(4-triphenylen-2-ylphenyl)phenyl]fluoren-2-amine
CID 142567679
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164768992
N-[4-(6-phenyldibenzofuran-2-yl)phenyl]-N-(3-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 168805215
N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)triphenylen-2-amine
CID 122470062
7-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 163827200
N-(4-dibenzofuran-4-ylphenyl)-N,2-diphenyl-9,9'-spirobi[fluorene]-2'-amine
CID 118298489

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine?
The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine (CID 137492501) is N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4cccc(-c5cccc6c5oc5cc(-c7ccc8c9ccccc9c9cc(N(c%10ccc(-c%11ccccc%11)cc%10)c%10ccc%11c(c%10)C(c%10ccccc%10)(c%10ccccc%10)c%10ccccc%10-%11)ccc9c8c7)ccc56)c4)cc3)cc2)cc1.
What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine?
The InChIKey is AITTXGVDWISNEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C109H72N2O/c1-6-22-73(23-7-1)76-40-44-78(45-41-76)81-50-56-88(57-51-81)110(89-58-52-82(53-59-89)79-46-42-77(43-47-79)74-24-8-2-9-25-74)91-33-20-28-85(68-91)94-37-21-38-102-101-65-55-84(70-107(101)112-108(94)102)83-54-64-97-95-34-16-17-35-96(95)104-71-92(62-66-98(104)103(97)69-83)111(90-60-48-80(49-61-90)75-26-10-3-11-27-75)93-63-67-100-99-36-18-19-39-105(99)109(106(100)72-93,86-29-12-4-13-30-86)87-31-14-5-15-32-87/h1-72H.
What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine?
N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine has a molecular weight of 1425.79 g/mol, XLogP of 30.02, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)-6-[6-[3-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]dibenzofuran-3-yl]triphenylen-2-amine is sourced from PubChem (CID 137492501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).