N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine

C194H133N5S — CID 162233532

IUPACN-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc32)cc1
InChIInChI=1S/C68H46N2.C68H45NS.C58H42N2/c1-5-21-47(22-6-1)67(48-23-7-2-8-24-48)61-33-17-13-29-55(61)57-43-41-53(45-63(57)67)69(51-37-39-52(40-38-51)70-65-35-19-15-31-59(65)60-32-16-20-36-66(60)70)54-42-44-58-56-30-14-18-34-62(56)68(64(58)46-54,49-25-9-3-10-26-49)50-27-11-4-12-28-50;1-5-19-48(20-6-1)67(49-21-7-2-8-22-49)61-30-16-13-27-55(61)57-40-38-53(44-63(57)67)69(52-36-33-46(34-37-52)47-35-42-66-60(43-47)59-29-15-18-32-65(59)70-66)54-39-41-58-56-28-14-17-31-62(56)68(64(58)45-54,50-23-9-3-10-24-50)51-25-11-4-12-26-51;1-57(2)51-25-13-9-21-45(51)47-35-33-43(37-53(47)57)59(41-29-31-42(32-30-41)60-55-27-15-11-23-49(55)50-24-12-16-28-56(50)60)44-34-36-48-46-22-10-14-26-52(46)58(54(48)38-44,39-17-5-3-6-18-39)40-19-7-4-8-20-40/h1-46H;1-45H;3-38H,1-2H3
InChIKeyZVTJYJXXEVRLIJ-UHFFFAOYSA-N
MW2566.30 g/mol
LogP49.82
Rot. Bonds22

About N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine

N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine (PubChem CID 162233532) has the molecular formula C194H133N5S and a molecular weight of 2566.30 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine
PubChem CID162233532
Molecular FormulaC194H133N5S
Molecular Weight2566.30 g/mol
Exact Mass2564.03
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc32)cc1
InChIInChI=1S/C68H46N2.C68H45NS.C58H42N2/c1-5-21-47(22-6-1)67(48-23-7-2-8-24-48)61-33-17-13-29-55(61)57-43-41-53(45-63(57)67)69(51-37-39-52(40-38-51)70-65-35-19-15-31-59(65)60-32-16-20-36-66(60)70)54-42-44-58-56-30-14-18-34-62(56)68(64(58)46-54,49-25-9-3-10-26-49)50-27-11-4-12-28-50;1-5-19-48(20-6-1)67(49-21-7-2-8-22-49)61-30-16-13-27-55(61)57-40-38-53(44-63(57)67)69(52-36-33-46(34-37-52)47-35-42-66-60(43-47)59-29-15-18-32-65(59)70-66)54-39-41-58-56-28-14-17-31-62(56)68(64(58)45-54,50-23-9-3-10-24-50)51-25-11-4-12-26-51;1-57(2)51-25-13-9-21-45(51)47-35-33-43(37-53(47)57)59(41-29-31-42(32-30-41)60-55-27-15-11-23-49(55)50-24-12-16-28-56(50)60)44-34-36-48-46-22-10-14-26-52(46)58(54(48)38-44,39-17-5-3-6-18-39)40-19-7-4-8-20-40/h1-46H;1-45H;3-38H,1-2H3
InChIKeyZVTJYJXXEVRLIJ-UHFFFAOYSA-N
XLogP49.82
TPSA19.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds22
Heavy Atoms200
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002566.30
LogP ≤ 549.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine (CID 162233532) is N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc32)cc1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine?
The InChIKey is ZVTJYJXXEVRLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H46N2.C68H45NS.C58H42N2/c1-5-21-47(22-6-1)67(48-23-7-2-8-24-48)61-33-17-13-29-55(61)57-43-41-53(45-63(57)67)69(51-37-39-52(40-38-51)70-65-35-19-15-31-59(65)60-32-16-20-36-66(60)70)54-42-44-58-56-30-14-18-34-62(56)68(64(58)46-54,49-25-9-3-10-26-49)50-27-11-4-12-28-50;1-5-19-48(20-6-1)67(49-21-7-2-8-22-49)61-30-16-13-27-55(61)57-40-38-53(44-63(57)67)69(52-36-33-46(34-37-52)47-35-42-66-60(43-47)59-29-15-18-32-65(59)70-66)54-39-41-58-56-28-14-17-31-62(56)68(64(58)45-54,50-23-9-3-10-24-50)51-25-11-4-12-26-51;1-57(2)51-25-13-9-21-45(51)47-35-33-43(37-53(47)57)59(41-29-31-42(32-30-41)60-55-27-15-11-23-49(55)50-24-12-16-28-56(50)60)44-34-36-48-46-22-10-14-26-52(46)58(54(48)38-44,39-17-5-3-6-18-39)40-19-7-4-8-20-40/h1-46H;1-45H;3-38H,1-2H3.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine?
N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine has a molecular weight of 2566.30 g/mol, XLogP of 49.82, 22 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine is sourced from PubChem (CID 162233532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).