N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine

C201H132N6O3 — CID 159482642

IUPACN-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3cc5c(cc34)-c3ccccc3C5(c3ccccc3)c3ccccc3)c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)c3cccc4c3oc3cc5c(cc34)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5cc6c(cc5c4c3)-c3ccccc3C6(c3ccccc3)c3ccccc3)c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1
InChIInChI=1S/3C67H44N2O/c1-5-18-45(19-6-1)47-32-36-51(37-33-47)68(53-40-41-56-55-27-14-16-30-62(55)69(64(56)42-53)52-38-34-48(35-39-52)46-20-7-2-8-21-46)63-31-17-28-57-59-43-58-54-26-13-15-29-60(54)67(49-22-9-3-10-23-49,50-24-11-4-12-25-50)61(58)44-65(59)70-66(57)63;1-5-17-45(18-6-1)47-29-33-51(34-30-47)68(54-37-39-57-56-26-14-16-28-63(56)69(64(57)42-54)52-35-31-48(32-36-52)46-19-7-2-8-20-46)53-38-40-65-59(41-53)60-43-58-55-25-13-15-27-61(55)67(49-21-9-3-10-22-49,50-23-11-4-12-24-50)62(58)44-66(60)70-65;1-5-17-45(18-6-1)47-29-33-51(34-30-47)68(53-37-39-57-56-26-14-16-28-63(56)69(64(57)41-53)52-35-31-48(32-36-52)46-19-7-2-8-20-46)54-38-40-58-60-43-59-55-25-13-15-27-61(55)67(49-21-9-3-10-22-49,50-23-11-4-12-24-50)62(59)44-66(60)70-65(58)42-54/h3*1-44H
InChIKeyLXEPYOGETPBBPM-UHFFFAOYSA-N
MW2679.31 g/mol
LogP53.55
Rot. Bonds24

About N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine

N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine (PubChem CID 159482642) has the molecular formula C201H132N6O3 and a molecular weight of 2679.31 g/mol. Its IUPAC name is N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound NameN-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine
PubChem CID159482642
Molecular FormulaC201H132N6O3
Molecular Weight2679.31 g/mol
Exact Mass2677.04
IUPAC NameN-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3cc5c(cc34)-c3ccccc3C5(c3ccccc3)c3ccccc3)c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)c3cccc4c3oc3cc5c(cc34)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5cc6c(cc5c4c3)-c3ccccc3C6(c3ccccc3)c3ccccc3)c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1
InChIInChI=1S/3C67H44N2O/c1-5-18-45(19-6-1)47-32-36-51(37-33-47)68(53-40-41-56-55-27-14-16-30-62(55)69(64(56)42-53)52-38-34-48(35-39-52)46-20-7-2-8-21-46)63-31-17-28-57-59-43-58-54-26-13-15-29-60(54)67(49-22-9-3-10-23-49,50-24-11-4-12-25-50)61(58)44-65(59)70-66(57)63;1-5-17-45(18-6-1)47-29-33-51(34-30-47)68(54-37-39-57-56-26-14-16-28-63(56)69(64(57)42-54)52-35-31-48(32-36-52)46-19-7-2-8-20-46)53-38-40-65-59(41-53)60-43-58-55-25-13-15-27-61(55)67(49-21-9-3-10-22-49,50-23-11-4-12-24-50)62(58)44-66(60)70-65;1-5-17-45(18-6-1)47-29-33-51(34-30-47)68(53-37-39-57-56-26-14-16-28-63(56)69(64(57)41-53)52-35-31-48(32-36-52)46-19-7-2-8-20-46)54-38-40-58-60-43-59-55-25-13-15-27-61(55)67(49-21-9-3-10-22-49,50-23-11-4-12-24-50)62(59)44-66(60)70-65(58)42-54/h3*1-44H
InChIKeyLXEPYOGETPBBPM-UHFFFAOYSA-N
XLogP53.55
TPSA63.93 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds24
Heavy Atoms210
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002679.31
LogP ≤ 553.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine?
The IUPAC name of N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine (CID 159482642) is N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine?
The canonical SMILES for N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)oc3cc5c(cc34)-c3ccccc3C5(c3ccccc3)c3ccccc3)c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)c3cccc4c3oc3cc5c(cc34)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5cc6c(cc5c4c3)-c3ccccc3C6(c3ccccc3)c3ccccc3)c3ccc4c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1.
What is the InChIKey of N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine?
The InChIKey is LXEPYOGETPBBPM-UHFFFAOYSA-N. The full InChI is InChI=1S/3C67H44N2O/c1-5-18-45(19-6-1)47-32-36-51(37-33-47)68(53-40-41-56-55-27-14-16-30-62(55)69(64(56)42-53)52-38-34-48(35-39-52)46-20-7-2-8-21-46)63-31-17-28-57-59-43-58-54-26-13-15-29-60(54)67(49-22-9-3-10-23-49,50-24-11-4-12-25-50)61(58)44-65(59)70-66(57)63;1-5-17-45(18-6-1)47-29-33-51(34-30-47)68(54-37-39-57-56-26-14-16-28-63(56)69(64(57)42-54)52-35-31-48(32-36-52)46-19-7-2-8-20-46)53-38-40-65-59(41-53)60-43-58-55-25-13-15-27-61(55)67(49-21-9-3-10-22-49,50-23-11-4-12-24-50)62(58)44-66(60)70-65;1-5-17-45(18-6-1)47-29-33-51(34-30-47)68(53-37-39-57-56-26-14-16-28-63(56)69(64(57)41-53)52-35-31-48(32-36-52)46-19-7-2-8-20-46)54-38-40-58-60-43-59-55-25-13-15-27-61(55)67(49-21-9-3-10-22-49,50-23-11-4-12-24-50)62(59)44-66(60)70-65(58)42-54/h3*1-44H.
What are the key properties of N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine?
N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine has a molecular weight of 2679.31 g/mol, XLogP of 53.55, 24 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-2-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-3-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine;N-(7,7-diphenylfluoreno[2,3-b][1]benzofuran-4-yl)-N,9-bis(4-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 159482642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).