N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline

C243H152N4O12 — CID 158947437

IUPACN,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline
SMILESCC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc21.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc(-c5ccc(N(c6ccc(-c7ccc8oc9ccccc9c8c7)cc6)c6ccc(-c7ccc8oc9ccccc9c8c7)cc6)cc5)cc4)cc3)cc12.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)cc3)cc12.c1ccc2c(c1)oc1ccc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)cc12
InChIInChI=1S/C66H41NO3.C63H41NO3.C60H37NO3.C54H33NO3/c1-4-10-61-55(7-1)58-39-49(27-36-64(58)68-61)46-19-17-43(18-20-46)42-13-15-44(16-14-42)45-21-30-52(31-22-45)67(53-32-23-47(24-33-53)50-28-37-65-59(40-50)56-8-2-5-11-62(56)69-65)54-34-25-48(26-35-54)51-29-38-66-60(41-51)57-9-3-6-12-63(57)70-66;1-63(2)55-36-43(42-22-32-62-54(35-42)51-11-5-8-14-59(51)67-62)19-28-47(55)48-29-27-46(37-56(48)63)64(44-23-15-38(16-24-44)40-20-30-60-52(33-40)49-9-3-6-12-57(49)65-60)45-25-17-39(18-26-45)41-21-31-61-53(34-41)50-10-4-7-13-58(50)66-61;1-4-10-55-49(7-1)52-35-43(23-32-58(52)62-55)40-15-13-38(14-16-40)39-17-26-46(27-18-39)61(47-28-19-41(20-29-47)44-24-33-59-53(36-44)50-8-2-5-11-56(50)63-59)48-30-21-42(22-31-48)45-25-34-60-54(37-45)51-9-3-6-12-57(51)64-60;1-4-10-49-43(7-1)46-31-37(19-28-52(46)56-49)34-13-22-40(23-14-34)55(41-24-15-35(16-25-41)38-20-29-53-47(32-38)44-8-2-5-11-50(44)57-53)42-26-17-36(18-27-42)39-21-30-54-48(33-39)45-9-3-6-12-51(45)58-54/h1-41H;3-37H,1-2H3;1-37H;1-33H
InChIKeyJKZPFASZTRDWIG-UHFFFAOYSA-N
MW3319.90 g/mol
LogP70.73
Rot. Bonds27

About N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline

N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline (PubChem CID 158947437) has the molecular formula C243H152N4O12 and a molecular weight of 3319.90 g/mol. Its IUPAC name is N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline.

Molecular Properties

Compound NameN,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline
PubChem CID158947437
Molecular FormulaC243H152N4O12
Molecular Weight3319.90 g/mol
Exact Mass3317.14
IUPAC NameN,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline
SMILESCC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc21.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc(-c5ccc(N(c6ccc(-c7ccc8oc9ccccc9c8c7)cc6)c6ccc(-c7ccc8oc9ccccc9c8c7)cc6)cc5)cc4)cc3)cc12.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)cc3)cc12.c1ccc2c(c1)oc1ccc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)cc12
InChIInChI=1S/C66H41NO3.C63H41NO3.C60H37NO3.C54H33NO3/c1-4-10-61-55(7-1)58-39-49(27-36-64(58)68-61)46-19-17-43(18-20-46)42-13-15-44(16-14-42)45-21-30-52(31-22-45)67(53-32-23-47(24-33-53)50-28-37-65-59(40-50)56-8-2-5-11-62(56)69-65)54-34-25-48(26-35-54)51-29-38-66-60(41-51)57-9-3-6-12-63(57)70-66;1-63(2)55-36-43(42-22-32-62-54(35-42)51-11-5-8-14-59(51)67-62)19-28-47(55)48-29-27-46(37-56(48)63)64(44-23-15-38(16-24-44)40-20-30-60-52(33-40)49-9-3-6-12-57(49)65-60)45-25-17-39(18-26-45)41-21-31-61-53(34-41)50-10-4-7-13-58(50)66-61;1-4-10-55-49(7-1)52-35-43(23-32-58(52)62-55)40-15-13-38(14-16-40)39-17-26-46(27-18-39)61(47-28-19-41(20-29-47)44-24-33-59-53(36-44)50-8-2-5-11-56(50)63-59)48-30-21-42(22-31-48)45-25-34-60-54(37-45)51-9-3-6-12-57(51)64-60;1-4-10-49-43(7-1)46-31-37(19-28-52(46)56-49)34-13-22-40(23-14-34)55(41-24-15-35(16-25-41)38-20-29-53-47(32-38)44-8-2-5-11-50(44)57-53)42-26-17-36(18-27-42)39-21-30-54-48(33-39)45-9-3-6-12-51(45)58-54/h1-41H;3-37H,1-2H3;1-37H;1-33H
InChIKeyJKZPFASZTRDWIG-UHFFFAOYSA-N
XLogP70.73
TPSA170.64 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds27
Heavy Atoms259
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003319.90
LogP ≤ 570.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline?
The IUPAC name of N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline (CID 158947437) is N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline.
What is the SMILES notation for N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline?
The canonical SMILES for N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline is CC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc21.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc(-c5ccc(N(c6ccc(-c7ccc8oc9ccccc9c8c7)cc6)c6ccc(-c7ccc8oc9ccccc9c8c7)cc6)cc5)cc4)cc3)cc12.c1ccc2c(c1)oc1ccc(-c3ccc(-c4ccc(N(c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)cc3)cc12.c1ccc2c(c1)oc1ccc(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)cc3)cc12.
What is the InChIKey of N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline?
The InChIKey is JKZPFASZTRDWIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H41NO3.C63H41NO3.C60H37NO3.C54H33NO3/c1-4-10-61-55(7-1)58-39-49(27-36-64(58)68-61)46-19-17-43(18-20-46)42-13-15-44(16-14-42)45-21-30-52(31-22-45)67(53-32-23-47(24-33-53)50-28-37-65-59(40-50)56-8-2-5-11-62(56)69-65)54-34-25-48(26-35-54)51-29-38-66-60(41-51)57-9-3-6-12-63(57)70-66;1-63(2)55-36-43(42-22-32-62-54(35-42)51-11-5-8-14-59(51)67-62)19-28-47(55)48-29-27-46(37-56(48)63)64(44-23-15-38(16-24-44)40-20-30-60-52(33-40)49-9-3-6-12-57(49)65-60)45-25-17-39(18-26-45)41-21-31-61-53(34-41)50-10-4-7-13-58(50)66-61;1-4-10-55-49(7-1)52-35-43(23-32-58(52)62-55)40-15-13-38(14-16-40)39-17-26-46(27-18-39)61(47-28-19-41(20-29-47)44-24-33-59-53(36-44)50-8-2-5-11-56(50)63-59)48-30-21-42(22-31-48)45-25-34-60-54(37-45)51-9-3-6-12-57(51)64-60;1-4-10-49-43(7-1)46-31-37(19-28-52(46)56-49)34-13-22-40(23-14-34)55(41-24-15-35(16-25-41)38-20-29-53-47(32-38)44-8-2-5-11-50(44)57-53)42-26-17-36(18-27-42)39-21-30-54-48(33-39)45-9-3-6-12-51(45)58-54/h1-41H;3-37H,1-2H3;1-37H;1-33H.
What are the key properties of N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline?
N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline has a molecular weight of 3319.90 g/mol, XLogP of 70.73, 27 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline is sourced from PubChem (CID 158947437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).