N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine

C94H60N8 — CID 59501112

IUPACN-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
SMILESc1ccc2c(-c3ccc4c(c3)c3ccccc3n4-c3ccc(N(c4ccc(-c5nc6ccccc6nc5-c5ccc(N(c6ccc(-n7c8ccccc8c8cc(-c9cccc%10ccccc9%10)ccc87)cc6)c6cccc7cccnc67)cc5)cc4)c4cccc5cccnc45)cc3)cccc2c1
InChIInChI=1S/C94H60N8/c1-3-25-75-61(17-1)19-11-29-77(75)67-41-55-87-81(59-67)79-27-5-9-33-85(79)101(87)73-51-47-71(48-52-73)99(89-35-13-21-63-23-15-57-95-91(63)89)69-43-37-65(38-44-69)93-94(98-84-32-8-7-31-83(84)97-93)66-39-45-70(46-40-66)100(90-36-14-22-64-24-16-58-96-92(64)90)72-49-53-74(54-50-72)102-86-34-10-6-28-80(86)82-60-68(42-56-88(82)102)78-30-12-20-62-18-2-4-26-76(62)78/h1-60H
InChIKeyCPCAWQFLVTXGNF-UHFFFAOYSA-N
MW1301.57 g/mol
LogP24.83
Rot. Bonds12

About N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine

N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine (PubChem CID 59501112) has the molecular formula C94H60N8 and a molecular weight of 1301.57 g/mol. Its IUPAC name is N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine.

Molecular Properties

Compound NameN-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
PubChem CID59501112
Molecular FormulaC94H60N8
Molecular Weight1301.57 g/mol
Exact Mass1300.49
IUPAC NameN-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
SMILESc1ccc2c(-c3ccc4c(c3)c3ccccc3n4-c3ccc(N(c4ccc(-c5nc6ccccc6nc5-c5ccc(N(c6ccc(-n7c8ccccc8c8cc(-c9cccc%10ccccc9%10)ccc87)cc6)c6cccc7cccnc67)cc5)cc4)c4cccc5cccnc45)cc3)cccc2c1
InChIInChI=1S/C94H60N8/c1-3-25-75-61(17-1)19-11-29-77(75)67-41-55-87-81(59-67)79-27-5-9-33-85(79)101(87)73-51-47-71(48-52-73)99(89-35-13-21-63-23-15-57-95-91(63)89)69-43-37-65(38-44-69)93-94(98-84-32-8-7-31-83(84)97-93)66-39-45-70(46-40-66)100(90-36-14-22-64-24-16-58-96-92(64)90)72-49-53-74(54-50-72)102-86-34-10-6-28-80(86)82-60-68(42-56-88(82)102)78-30-12-20-62-18-2-4-26-76(62)78/h1-60H
InChIKeyCPCAWQFLVTXGNF-UHFFFAOYSA-N
XLogP24.83
TPSA67.90 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms102
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001301.57
LogP ≤ 524.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
The IUPAC name of N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine (CID 59501112) is N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine.
What is the SMILES notation for N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
The canonical SMILES for N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine is c1ccc2c(-c3ccc4c(c3)c3ccccc3n4-c3ccc(N(c4ccc(-c5nc6ccccc6nc5-c5ccc(N(c6ccc(-n7c8ccccc8c8cc(-c9cccc%10ccccc9%10)ccc87)cc6)c6cccc7cccnc67)cc5)cc4)c4cccc5cccnc45)cc3)cccc2c1.
What is the InChIKey of N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
The InChIKey is CPCAWQFLVTXGNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C94H60N8/c1-3-25-75-61(17-1)19-11-29-77(75)67-41-55-87-81(59-67)79-27-5-9-33-85(79)101(87)73-51-47-71(48-52-73)99(89-35-13-21-63-23-15-57-95-91(63)89)69-43-37-65(38-44-69)93-94(98-84-32-8-7-31-83(84)97-93)66-39-45-70(46-40-66)100(90-36-14-22-64-24-16-58-96-92(64)90)72-49-53-74(54-50-72)102-86-34-10-6-28-80(86)82-60-68(42-56-88(82)102)78-30-12-20-62-18-2-4-26-76(62)78/h1-60H.
What are the key properties of N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine?
N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine has a molecular weight of 1301.57 g/mol, XLogP of 24.83, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-naphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3-naphthalen-1-ylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine is sourced from PubChem (CID 59501112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).