N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine

C59H38N2O — CID 167036314

IUPACN-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine
SMILESc1ccc(-n2c3ccccc3c3cc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc6ccccc6cc4-5)c4cccc5c4oc4ccccc45)ccc32)cc1
InChIInChI=1S/C59H38N2O/c1-4-19-41(20-5-1)59(42-21-6-2-7-22-42)52-36-40-18-11-10-17-39(40)35-50(52)46-33-31-45(38-53(46)59)60(56-29-16-27-49-48-26-13-15-30-57(48)62-58(49)56)44-32-34-55-51(37-44)47-25-12-14-28-54(47)61(55)43-23-8-3-9-24-43/h1-38H
InChIKeyAJGPKYQHUFPJKP-UHFFFAOYSA-N
MW790.97 g/mol
LogP15.67
Rot. Bonds6

About N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine

N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine (PubChem CID 167036314) has the molecular formula C59H38N2O and a molecular weight of 790.97 g/mol. Its IUPAC name is N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine.

Molecular Properties

Compound NameN-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine
PubChem CID167036314
Molecular FormulaC59H38N2O
Molecular Weight790.97 g/mol
Exact Mass790.30
IUPAC NameN-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine
SMILESc1ccc(-n2c3ccccc3c3cc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc6ccccc6cc4-5)c4cccc5c4oc4ccccc45)ccc32)cc1
InChIInChI=1S/C59H38N2O/c1-4-19-41(20-5-1)59(42-21-6-2-7-22-42)52-36-40-18-11-10-17-39(40)35-50(52)46-33-31-45(38-53(46)59)60(56-29-16-27-49-48-26-13-15-30-57(48)62-58(49)56)44-32-34-55-51(37-44)47-25-12-14-28-54(47)61(55)43-23-8-3-9-24-43/h1-38H
InChIKeyAJGPKYQHUFPJKP-UHFFFAOYSA-N
XLogP15.67
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500790.97
LogP ≤ 515.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-N,20-N-bis(9,9-dimethylfluoren-2-yl)-5-N,20-N,25,25-tetraphenylhexacyclo[12.11.0.02,7.08,13.015,24.017,22]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18,20,22-dodecaene-5,20-diamine;5-N,20-N-di(dibenzofuran-4-yl)-5-N,20-N,25,25-tetraphenylhexacyclo[12.11.0.02,7.08,13.015,24.017,22]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18,20,22-dodecaene-5,20-diamine;5-N,20-N,25,25-tetraphenyl-5-N,20-N-bis(9-phenylcarbazol-3-yl)hexacyclo[12.11.0.02,7.08,13.015,24.017,22]pentacosa-1(14),2(7),3,5,8,10,12,15(24),16,18,20,22-dodecaene-5,20-diamine
CID 160662671
N-dibenzofuran-4-yl-N-(9,9-dimethyl-7-phenylfluoren-2-yl)-9-phenylcarbazol-3-amine
CID 58510703
N-(4-carbazol-9-ylphenyl)-9,9-diphenyl-N-(2-phenylphenyl)fluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N,9,9-triphenylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-(3-phenylphenyl)dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 164956746
N-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 164769090
N-dibenzofuran-4-yl-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine
CID 58510678
N-[9-(4-dibenzofuran-4-ylphenyl)-9-(4-phenylphenyl)fluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 154955024
N-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-amine
CID 67964581
N,9-diphenyl-N-[11-phenyl-11-(4-phenylphenyl)benzo[b]fluoren-2-yl]carbazol-3-amine
CID 167036355
N-chrysen-1-yl-N-dibenzofuran-4-yl-9-phenylcarbazol-3-amine
CID 170138972
N-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzofuran-4-amine
CID 71038532
N-[9,9-dimethyl-7-(9-phenylcarbazol-2-yl)fluoren-2-yl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-4-amine;N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-4-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]dibenzofuran-4-amine
CID 158810428
N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine
CID 159482642

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine?
The IUPAC name of N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine (CID 167036314) is N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine.
What is the SMILES notation for N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine?
The canonical SMILES for N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine is c1ccc(-n2c3ccccc3c3cc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc6ccccc6cc4-5)c4cccc5c4oc4ccccc45)ccc32)cc1.
What is the InChIKey of N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine?
The InChIKey is AJGPKYQHUFPJKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H38N2O/c1-4-19-41(20-5-1)59(42-21-6-2-7-22-42)52-36-40-18-11-10-17-39(40)35-50(52)46-33-31-45(38-53(46)59)60(56-29-16-27-49-48-26-13-15-30-57(48)62-58(49)56)44-32-34-55-51(37-44)47-25-12-14-28-54(47)61(55)43-23-8-3-9-24-43/h1-38H.
What are the key properties of N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine?
N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine has a molecular weight of 790.97 g/mol, XLogP of 15.67, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine is sourced from PubChem (CID 167036314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).