N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine

C71H46N2O — CID 118337434

IUPACN-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccccc4-c4ccccc4-c4ccc5c6ccccc6n(-c6cccc7oc8ccccc8c67)c5c4)c4cccc5ccccc45)cc32)cc1
InChIInChI=1S/C71H46N2O/c1-3-23-49(24-4-1)71(50-25-5-2-6-26-50)61-34-15-11-30-55(61)56-44-42-51(46-62(56)71)72(63-37-19-22-47-21-7-8-28-53(47)63)64-35-16-12-31-57(64)54-29-10-9-27-52(54)48-41-43-59-58-32-13-17-36-65(58)73(67(59)45-48)66-38-20-40-69-70(66)60-33-14-18-39-68(60)74-69/h1-46H
InChIKeyKMWUGPJWPWBVDU-UHFFFAOYSA-N
MW943.16 g/mol
LogP19.00
Rot. Bonds8

About N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine

N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine (PubChem CID 118337434) has the molecular formula C71H46N2O and a molecular weight of 943.16 g/mol. Its IUPAC name is N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine.

Molecular Properties

Compound NameN-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine
PubChem CID118337434
Molecular FormulaC71H46N2O
Molecular Weight943.16 g/mol
Exact Mass942.36
IUPAC NameN-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccccc4-c4ccccc4-c4ccc5c6ccccc6n(-c6cccc7oc8ccccc8c67)c5c4)c4cccc5ccccc45)cc32)cc1
InChIInChI=1S/C71H46N2O/c1-3-23-49(24-4-1)71(50-25-5-2-6-26-50)61-34-15-11-30-55(61)56-44-42-51(46-62(56)71)72(63-37-19-22-47-21-7-8-28-53(47)63)64-35-16-12-31-57(64)54-29-10-9-27-52(54)48-41-43-59-58-32-13-17-36-65(58)73(67(59)45-48)66-38-20-40-69-70(66)60-33-14-18-39-68(60)74-69/h1-46H
InChIKeyKMWUGPJWPWBVDU-UHFFFAOYSA-N
XLogP19.00
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms74
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500943.16
LogP ≤ 519.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(9-dibenzofuran-2-ylcarbazol-3-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine
CID 118086732
9-dibenzofuran-1-yl-N-naphthalen-1-yl-N-spiro[benzo[a]phenalene-7,9'-thioxanthene]-9-ylcarbazol-2-amine
CID 164794905
2-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]-N,N-bis(3-phenylphenyl)aniline;N-[2-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine;N-[2-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 161069792
2-[2-[9-(9,9-diphenylfluoren-1-yl)carbazol-2-yl]phenyl]-N,N-bis(4-phenylphenyl)aniline
CID 118337373
N-[3-[2-[9-(9,9-diphenylfluoren-1-yl)carbazol-2-yl]phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine;N-[3-[2-[9-(9,9-diphenylfluoren-1-yl)carbazol-2-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine;N-[3-[2-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-3-phenyl-N-(3-phenylphenyl)aniline;N-[3-[2-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 159417227
N-(4-dibenzofuran-1-ylphenyl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine
CID 135166539
9,9-diphenyl-N-[2-(2-phenylphenyl)phenyl]-N-(4-spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-ylnaphthalen-1-yl)fluoren-2-amine
CID 135167159
N-(9,9-diphenylfluoren-2-yl)-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-1-amine
CID 170302496
9-dibenzofuran-1-yl-N-naphthalen-1-yl-N-spiro[benzo[a]phenalene-7,9'-thioxanthene]-3-ylcarbazol-3-amine
CID 164794741
N-(3-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-2-amine
CID 170535410
N-naphthalen-1-yl-9,9-diphenyl-N-[3-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[3-[9-[4-(2-phenylphenyl)phenyl]carbazol-2-yl]phenyl]naphthalen-1-amine;3-phenyl-N-(3-phenylphenyl)-N-[3-[9-[3-(2-phenylphenyl)phenyl]carbazol-2-yl]phenyl]aniline
CID 158858798
N-(2-carbazol-9-ylphenyl)-N-[2-[3-[4-[2-[4-(2-carbazol-9-ylphenyl)-N-(2-naphtho[1,2-b][1]benzofuran-8-ylphenyl)anilino]-9-phenylfluoren-9-yl]phenyl]naphtho[1,2-b][1]benzofuran-8-yl]phenyl]dibenzofuran-3-amine
CID 174287860

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?
The IUPAC name of N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine (CID 118337434) is N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine.
What is the SMILES notation for N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?
The canonical SMILES for N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccccc4-c4ccccc4-c4ccc5c6ccccc6n(-c6cccc7oc8ccccc8c67)c5c4)c4cccc5ccccc45)cc32)cc1.
What is the InChIKey of N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?
The InChIKey is KMWUGPJWPWBVDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H46N2O/c1-3-23-49(24-4-1)71(50-25-5-2-6-26-50)61-34-15-11-30-55(61)56-44-42-51(46-62(56)71)72(63-37-19-22-47-21-7-8-28-53(47)63)64-35-16-12-31-57(64)54-29-10-9-27-52(54)48-41-43-59-58-32-13-17-36-65(58)73(67(59)45-48)66-38-20-40-69-70(66)60-33-14-18-39-68(60)74-69/h1-46H.
What are the key properties of N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine?
N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine has a molecular weight of 943.16 g/mol, XLogP of 19.00, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(9-dibenzofuran-1-ylcarbazol-2-yl)phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine is sourced from PubChem (CID 118337434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).