N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

C130H88N4O — CID 165090747

IUPACN-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6-n6c7ccccc7c7cc(-c8ccccc8)ccc76)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5-n5c6ccccc6c6cc(-c7ccccc7)ccc65)cc4)cc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C72H48N2O.C58H40N2/c1-3-14-49(15-4-1)51-26-28-52(29-27-51)54-34-41-59(42-35-54)73(61-45-38-57(39-46-61)63-21-13-22-66-65-20-9-12-25-71(65)75-72(63)66)60-43-36-55(37-44-60)53-30-32-56(33-31-53)62-18-7-10-23-68(62)74-69-24-11-8-19-64(69)67-48-58(40-47-70(67)74)50-16-5-2-6-17-50;1-3-14-41(15-4-1)44-30-35-49(36-31-44)59(55-25-13-19-46-18-7-8-20-51(46)55)50-37-32-45(33-38-50)43-26-28-47(29-27-43)52-21-9-11-23-56(52)60-57-24-12-10-22-53(57)54-40-48(34-39-58(54)60)42-16-5-2-6-17-42/h1-48H;1-40H
InChIKeyWQTBGMIXDBDFIV-UHFFFAOYSA-N
MW1722.16 g/mol
LogP36.23
Rot. Bonds18

About N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine

N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine (PubChem CID 165090747) has the molecular formula C130H88N4O and a molecular weight of 1722.16 g/mol. Its IUPAC name is N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
PubChem CID165090747
Molecular FormulaC130H88N4O
Molecular Weight1722.16 g/mol
Exact Mass1720.70
IUPAC NameN-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6-n6c7ccccc7c7cc(-c8ccccc8)ccc76)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5-n5c6ccccc6c6cc(-c7ccccc7)ccc65)cc4)cc3)c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C72H48N2O.C58H40N2/c1-3-14-49(15-4-1)51-26-28-52(29-27-51)54-34-41-59(42-35-54)73(61-45-38-57(39-46-61)63-21-13-22-66-65-20-9-12-25-71(65)75-72(63)66)60-43-36-55(37-44-60)53-30-32-56(33-31-53)62-18-7-10-23-68(62)74-69-24-11-8-19-64(69)67-48-58(40-47-70(67)74)50-16-5-2-6-17-50;1-3-14-41(15-4-1)44-30-35-49(36-31-44)59(55-25-13-19-46-18-7-8-20-51(46)55)50-37-32-45(33-38-50)43-26-28-47(29-27-43)52-21-9-11-23-56(52)60-57-24-12-10-22-53(57)54-40-48(34-39-58(54)60)42-16-5-2-6-17-42/h1-48H;1-40H
InChIKeyWQTBGMIXDBDFIV-UHFFFAOYSA-N
XLogP36.23
TPSA29.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds18
Heavy Atoms135
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001722.16
LogP ≤ 536.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine (CID 165090747) is N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6-n6c7ccccc7c7cc(-c8ccccc8)ccc76)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5-n5c6ccccc6c6cc(-c7ccccc7)ccc65)cc4)cc3)c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
The InChIKey is WQTBGMIXDBDFIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H48N2O.C58H40N2/c1-3-14-49(15-4-1)51-26-28-52(29-27-51)54-34-41-59(42-35-54)73(61-45-38-57(39-46-61)63-21-13-22-66-65-20-9-12-25-71(65)75-72(63)66)60-43-36-55(37-44-60)53-30-32-56(33-31-53)62-18-7-10-23-68(62)74-69-24-11-8-19-64(69)67-48-58(40-47-70(67)74)50-16-5-2-6-17-50;1-3-14-41(15-4-1)44-30-35-49(36-31-44)59(55-25-13-19-46-18-7-8-20-51(46)55)50-37-32-45(33-38-50)43-26-28-47(29-27-43)52-21-9-11-23-56(52)60-57-24-12-10-22-53(57)54-40-48(34-39-58(54)60)42-16-5-2-6-17-42/h1-48H;1-40H.
What are the key properties of N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine?
N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine has a molecular weight of 1722.16 g/mol, XLogP of 36.23, 18 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-4-ylphenyl)-N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)aniline;N-[4-[4-[2-(3-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 165090747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).