2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine

C173H133N9 — CID 162131093

IUPAC2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine
SMILESCC.CC.CC.c1ccc(N(c2ccc3c(c2)Cc2cc(-n4c5ccccc5c5ccccc54)ccc2-3)c2ccc3c(c2)Cc2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Cc2cc(N(c4ccccc4)c4ccc5c(c4)Cc4cc(N(c6ccccc6)c6ccccc6)ccc4-5)ccc2-3)cc1.c1ccc(N2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3Cc3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1
InChIInChI=1S/C56H37N3.C56H41N3.C55H37N3.3C2H6/c1-2-12-40(13-3-1)57(41-22-26-45-36(32-41)30-38-34-43(24-28-47(38)45)58-53-18-8-4-14-49(53)50-15-5-9-19-54(50)58)42-23-27-46-37(33-42)31-39-35-44(25-29-48(39)46)59-55-20-10-6-16-51(55)52-17-7-11-21-56(52)59;1-6-16-44(17-7-1)57(45-18-8-2-9-19-45)49-26-30-53-40(36-49)34-42-38-51(28-32-55(42)53)59(48-24-14-5-15-25-48)52-29-33-56-43(39-52)35-41-37-50(27-31-54(41)56)58(46-20-10-3-11-21-46)47-22-12-4-13-23-47;1-2-12-43(13-3-1)56-50-32-26-39(37-22-28-44(29-23-37)57-52-18-8-4-14-46(52)47-15-5-9-19-53(47)57)34-41(50)36-42-35-40(27-33-51(42)56)38-24-30-45(31-25-38)58-54-20-10-6-16-48(54)49-17-7-11-21-55(49)58;3*1-2/h1-29,32-35H,30-31H2;1-33,36-39H,34-35H2;1-35H,36H2;3*1-2H3
InChIKeyZIRDAIBHEYHQFS-UHFFFAOYSA-N
MW2338.03 g/mol
LogP47.40
Rot. Bonds19

About 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine

2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine (PubChem CID 162131093) has the molecular formula C173H133N9 and a molecular weight of 2338.03 g/mol. Its IUPAC name is 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine.

Molecular Properties

Compound Name2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine
PubChem CID162131093
Molecular FormulaC173H133N9
Molecular Weight2338.03 g/mol
Exact Mass2336.07
IUPAC Name2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine
SMILESCC.CC.CC.c1ccc(N(c2ccc3c(c2)Cc2cc(-n4c5ccccc5c5ccccc54)ccc2-3)c2ccc3c(c2)Cc2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Cc2cc(N(c4ccccc4)c4ccc5c(c4)Cc4cc(N(c6ccccc6)c6ccccc6)ccc4-5)ccc2-3)cc1.c1ccc(N2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3Cc3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1
InChIInChI=1S/C56H37N3.C56H41N3.C55H37N3.3C2H6/c1-2-12-40(13-3-1)57(41-22-26-45-36(32-41)30-38-34-43(24-28-47(38)45)58-53-18-8-4-14-49(53)50-15-5-9-19-54(50)58)42-23-27-46-37(33-42)31-39-35-44(25-29-48(39)46)59-55-20-10-6-16-51(55)52-17-7-11-21-56(52)59;1-6-16-44(17-7-1)57(45-18-8-2-9-19-45)49-26-30-53-40(36-49)34-42-38-51(28-32-55(42)53)59(48-24-14-5-15-25-48)52-29-33-56-43(39-52)35-41-37-50(27-31-54(41)56)58(46-20-10-3-11-21-46)47-22-12-4-13-23-47;1-2-12-43(13-3-1)56-50-32-26-39(37-22-28-44(29-23-37)57-52-18-8-4-14-46(52)47-15-5-9-19-53(47)57)34-41(50)36-42-35-40(27-33-51(42)56)38-24-30-45(31-25-38)58-54-20-10-6-16-48(54)49-17-7-11-21-55(49)58;3*1-2/h1-29,32-35H,30-31H2;1-33,36-39H,34-35H2;1-35H,36H2;3*1-2H3
InChIKeyZIRDAIBHEYHQFS-UHFFFAOYSA-N
XLogP47.40
TPSA35.92 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds19
Heavy Atoms182
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002338.03
LogP ≤ 547.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine?
The IUPAC name of 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine (CID 162131093) is 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine.
What is the SMILES notation for 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine?
The canonical SMILES for 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine is CC.CC.CC.c1ccc(N(c2ccc3c(c2)Cc2cc(-n4c5ccccc5c5ccccc54)ccc2-3)c2ccc3c(c2)Cc2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Cc2cc(N(c4ccccc4)c4ccc5c(c4)Cc4cc(N(c6ccccc6)c6ccccc6)ccc4-5)ccc2-3)cc1.c1ccc(N2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3Cc3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1.
What is the InChIKey of 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine?
The InChIKey is ZIRDAIBHEYHQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37N3.C56H41N3.C55H37N3.3C2H6/c1-2-12-40(13-3-1)57(41-22-26-45-36(32-41)30-38-34-43(24-28-47(38)45)58-53-18-8-4-14-49(53)50-15-5-9-19-54(50)58)42-23-27-46-37(33-42)31-39-35-44(25-29-48(39)46)59-55-20-10-6-16-51(55)52-17-7-11-21-56(52)59;1-6-16-44(17-7-1)57(45-18-8-2-9-19-45)49-26-30-53-40(36-49)34-42-38-51(28-32-55(42)53)59(48-24-14-5-15-25-48)52-29-33-56-43(39-52)35-41-37-50(27-31-54(41)56)58(46-20-10-3-11-21-46)47-22-12-4-13-23-47;1-2-12-43(13-3-1)56-50-32-26-39(37-22-28-44(29-23-37)57-52-18-8-4-14-46(52)47-15-5-9-19-53(47)57)34-41(50)36-42-35-40(27-33-51(42)56)38-24-30-45(31-25-38)58-54-20-10-6-16-48(54)49-17-7-11-21-55(49)58;3*1-2/h1-29,32-35H,30-31H2;1-33,36-39H,34-35H2;1-35H,36H2;3*1-2H3.
What are the key properties of 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine?
2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine has a molecular weight of 2338.03 g/mol, XLogP of 47.40, 19 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-bis(4-carbazol-9-ylphenyl)-10-phenyl-9H-acridine;7-carbazol-9-yl-N-(7-carbazol-9-yl-9H-fluoren-2-yl)-N-phenyl-9H-fluoren-2-amine;ethane;2-N,7-N,7-N-triphenyl-2-N-[7-(N-phenylanilino)-9H-fluoren-2-yl]-9H-fluorene-2,7-diamine is sourced from PubChem (CID 162131093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).