N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine

C59H40N2 — CID 167036295

IUPACN-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3ccc(N(c4ccccc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc6ccccc6cc4-5)cc32)cc1
InChIInChI=1S/C59H40N2/c1-5-19-41(20-6-1)49-29-15-17-31-56(49)61-57-32-18-16-30-51(57)52-36-34-48(40-58(52)61)60(46-27-11-4-12-28-46)47-33-35-50-53-37-42-21-13-14-22-43(42)38-54(53)59(55(50)39-47,44-23-7-2-8-24-44)45-25-9-3-10-26-45/h1-40H
InChIKeyLRXOFGGNRSNNTR-UHFFFAOYSA-N
MW776.98 g/mol
LogP15.44
Rot. Bonds7

About N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine

N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine (PubChem CID 167036295) has the molecular formula C59H40N2 and a molecular weight of 776.98 g/mol. Its IUPAC name is N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound NameN-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine
PubChem CID167036295
Molecular FormulaC59H40N2
Molecular Weight776.98 g/mol
Exact Mass776.32
IUPAC NameN-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3ccc(N(c4ccccc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc6ccccc6cc4-5)cc32)cc1
InChIInChI=1S/C59H40N2/c1-5-19-41(20-6-1)49-29-15-17-31-56(49)61-57-32-18-16-30-51(57)52-36-34-48(40-58(52)61)60(46-27-11-4-12-28-46)47-33-35-50-53-37-42-21-13-14-22-43(42)38-54(53)59(55(50)39-47,44-23-7-2-8-24-44)45-25-9-3-10-26-45/h1-40H
InChIKeyLRXOFGGNRSNNTR-UHFFFAOYSA-N
XLogP15.44
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500776.98
LogP ≤ 515.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 166036387
N,9-diphenyl-N-[11-phenyl-11-(3-phenylphenyl)benzo[b]fluoren-2-yl]carbazol-2-amine
CID 167036284
N-naphthalen-2-yl-9-(2-phenylphenyl)-N-[9-phenyl-9-(3-phenylphenyl)fluoren-2-yl]carbazol-2-amine
CID 170375391
N,9-diphenyl-N-[11-phenyl-11-(4-phenylphenyl)benzo[b]fluoren-2-yl]carbazol-3-amine
CID 167036355
N-[4-[3-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 167322443
N-[3-(9-naphthalen-1-ylcarbazol-2-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[3-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[3-(9-naphthalen-1-ylcarbazol-2-yl)phenyl]-N,9,9-triphenylfluoren-2-amine
CID 160912599
N,9-diphenyl-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]carbazol-2-amine
CID 170375341
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,4-diphenylaniline;N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 165066958
N-[3-[3-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 129085062
N-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 122414007
N,9,9-triphenyl-N-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]fluoren-2-amine
CID 118505876
17-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-phenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaen-6-amine
CID 166032529

Frequently Asked Questions

What is the IUPAC name of N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine?
The IUPAC name of N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine (CID 167036295) is N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine?
The canonical SMILES for N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine is c1ccc(-c2ccccc2-n2c3ccccc3c3ccc(N(c4ccccc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4cc6ccccc6cc4-5)cc32)cc1.
What is the InChIKey of N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine?
The InChIKey is LRXOFGGNRSNNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H40N2/c1-5-19-41(20-6-1)49-29-15-17-31-56(49)61-57-32-18-16-30-51(57)52-36-34-48(40-58(52)61)60(46-27-11-4-12-28-46)47-33-35-50-53-37-42-21-13-14-22-43(42)38-54(53)59(55(50)39-47,44-23-7-2-8-24-44)45-25-9-3-10-26-45/h1-40H.
What are the key properties of N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine?
N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine has a molecular weight of 776.98 g/mol, XLogP of 15.44, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(11,11-diphenylbenzo[b]fluoren-2-yl)-N-phenyl-9-(2-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 167036295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).