N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline

C154H99N3O6 — CID 158761116

IUPACN,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccccc2-c2cccc(N(c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c2)cc1.c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5cccc6oc7ccccc7c56)cc4)cc3)cccc2c1
InChIInChI=1S/C54H35NO2.C52H33NO2.C48H31NO2/c1-2-11-38(12-3-1)45-15-4-5-16-46(45)41-13-10-14-44(33-41)55(42-27-21-36(22-28-42)39-25-31-49-47-17-6-8-19-51(47)56-53(49)34-39)43-29-23-37(24-30-43)40-26-32-50-48-18-7-9-20-52(48)57-54(50)35-40;1-2-11-42-35(9-1)10-7-14-43(42)36-21-28-40(29-22-36)53(39-26-19-34(20-27-39)38-25-32-50-47(33-38)45-12-3-5-16-48(45)54-50)41-30-23-37(24-31-41)44-15-8-18-51-52(44)46-13-4-6-17-49(46)55-51;1-2-10-32(11-3-1)33-20-26-36(27-21-33)49(37-28-22-34(23-29-37)39-14-8-16-43-41-12-4-6-18-45(41)50-47(39)43)38-30-24-35(25-31-38)40-15-9-17-44-42-13-5-7-19-46(42)51-48(40)44/h1-35H;1-33H;1-31H
InChIKeyIORIZXLNNLVYCJ-UHFFFAOYSA-N
MW2087.50 g/mol
LogP44.69
Rot. Bonds19

About N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline

N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline (PubChem CID 158761116) has the molecular formula C154H99N3O6 and a molecular weight of 2087.50 g/mol. Its IUPAC name is N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline.

Molecular Properties

Compound NameN,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline
PubChem CID158761116
Molecular FormulaC154H99N3O6
Molecular Weight2087.50 g/mol
Exact Mass2085.75
IUPAC NameN,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccccc2-c2cccc(N(c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c2)cc1.c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5cccc6oc7ccccc7c56)cc4)cc3)cccc2c1
InChIInChI=1S/C54H35NO2.C52H33NO2.C48H31NO2/c1-2-11-38(12-3-1)45-15-4-5-16-46(45)41-13-10-14-44(33-41)55(42-27-21-36(22-28-42)39-25-31-49-47-17-6-8-19-51(47)56-53(49)34-39)43-29-23-37(24-30-43)40-26-32-50-48-18-7-9-20-52(48)57-54(50)35-40;1-2-11-42-35(9-1)10-7-14-43(42)36-21-28-40(29-22-36)53(39-26-19-34(20-27-39)38-25-32-50-47(33-38)45-12-3-5-16-48(45)54-50)41-30-23-37(24-31-41)44-15-8-18-51-52(44)46-13-4-6-17-49(46)55-51;1-2-10-32(11-3-1)33-20-26-36(27-21-33)49(37-28-22-34(23-29-37)39-14-8-16-43-41-12-4-6-18-45(41)50-47(39)43)38-30-24-35(25-31-38)40-15-9-17-44-42-13-5-7-19-46(42)51-48(40)44/h1-35H;1-33H;1-31H
InChIKeyIORIZXLNNLVYCJ-UHFFFAOYSA-N
XLogP44.69
TPSA88.56 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds19
Heavy Atoms163
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002087.50
LogP ≤ 544.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline with MolForge

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Related Compounds

N,N-bis(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)aniline;N,N-bis[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3-(2-phenylphenyl)aniline;N-(4-dibenzofuran-1-ylphenyl)-4-(4-dibenzofuran-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline
CID 161497099
N-(4-naphthalen-1-ylphenyl)-3-(6-phenyldibenzofuran-4-yl)-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]aniline
CID 168804297
N-(4-dibenzofuran-4-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-3-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline
CID 157200619
3-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)aniline
CID 164961326
3-dibenzofuran-4-yl-N-[4-(3,4-diphenylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)aniline
CID 164831619
N-(4-dibenzofuran-2-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-3-phenylaniline
CID 167331100
N-(3-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-3-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-3-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-3-ylphenyl)-N-(4-dibenzofuran-3-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-4-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-4-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-4-ylphenyl)-N-(4-dibenzofuran-3-ylphenyl)dibenzothiophen-3-amine;N-(3-dibenzofuran-4-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)dibenzothiophen-3-amine
CID 164975390
7-phenyl-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 168805484
N-(4-dibenzofuran-1-ylphenyl)-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 168805047
3-dibenzofuran-4-yl-N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)aniline
CID 167329594
N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphtho[1,2-b][1]benzofuran-7-ylphenyl)-3-phenylaniline
CID 167329469
3-dibenzofuran-2-yl-N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 170535389

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline?
The IUPAC name of N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline (CID 158761116) is N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline.
What is the SMILES notation for N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline?
The canonical SMILES for N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccccc2-c2cccc(N(c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c3ccc(-c4ccc5c(c4)oc4ccccc45)cc3)c2)cc1.c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6oc7ccccc7c6c5)cc4)c4ccc(-c5cccc6oc7ccccc7c56)cc4)cc3)cccc2c1.
What is the InChIKey of N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline?
The InChIKey is IORIZXLNNLVYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35NO2.C52H33NO2.C48H31NO2/c1-2-11-38(12-3-1)45-15-4-5-16-46(45)41-13-10-14-44(33-41)55(42-27-21-36(22-28-42)39-25-31-49-47-17-6-8-19-51(47)56-53(49)34-39)43-29-23-37(24-30-43)40-26-32-50-48-18-7-9-20-52(48)57-54(50)35-40;1-2-11-42-35(9-1)10-7-14-43(42)36-21-28-40(29-22-36)53(39-26-19-34(20-27-39)38-25-32-50-47(33-38)45-12-3-5-16-48(45)54-50)41-30-23-37(24-31-41)44-15-8-18-51-52(44)46-13-4-6-17-49(46)55-51;1-2-10-32(11-3-1)33-20-26-36(27-21-33)49(37-28-22-34(23-29-37)39-14-8-16-43-41-12-4-6-18-45(41)50-47(39)43)38-30-24-35(25-31-38)40-15-9-17-44-42-13-5-7-19-46(42)51-48(40)44/h1-35H;1-33H;1-31H.
What are the key properties of N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline?
N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline has a molecular weight of 2087.50 g/mol, XLogP of 44.69, 19 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;N,N-bis(4-dibenzofuran-3-ylphenyl)-3-(2-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline is sourced from PubChem (CID 158761116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).