N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine

C175H127N5O2 — CID 161111008

IUPACN-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine
SMILESC1=CC2c3ccccc3N(c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)cc3)C2C=C1.C1=CC2c3ccccc3N(c3ccc(N(c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)c4cccc(-c5ccccc5)c4)cc3)C2C=C1.c1cc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3cc(-c4ccc5oc6ccccc6c5c4)ccc3c2)cc(C2(C3CCCCC3)c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C65H47NO2.2C55H40N2/c1-2-13-48(14-3-1)65(59-21-8-4-17-53(59)54-18-5-9-22-60(54)65)49-15-12-16-51(41-49)66(50-32-27-42(28-33-50)46-30-35-63-57(39-46)55-19-6-10-23-61(55)67-63)52-34-29-44-37-43(25-26-45(44)38-52)47-31-36-64-58(40-47)56-20-7-11-24-62(56)68-64;1-3-16-39(17-4-1)40-18-15-21-46(38-40)56(44-34-36-45(37-35-44)57-53-28-13-9-24-49(53)50-25-10-14-29-54(50)57)43-32-30-42(31-33-43)55(41-19-5-2-6-20-41)51-26-11-7-22-47(51)48-23-8-12-27-52(48)55;1-3-15-39(16-4-1)40-27-31-43(32-28-40)56(45-35-37-46(38-36-45)57-53-25-13-9-21-49(53)50-22-10-14-26-54(50)57)44-33-29-42(30-34-44)55(41-17-5-2-6-18-41)51-23-11-7-19-47(51)48-20-8-12-24-52(48)55/h4-12,15-41,48H,1-3,13-14H2;2*1-38,49,53H
InChIKeyUJRNOZUHGGINSW-UHFFFAOYSA-N
MW2331.97 g/mol
LogP46.17
Rot. Bonds21

About N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine

N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine (PubChem CID 161111008) has the molecular formula C175H127N5O2 and a molecular weight of 2331.97 g/mol. Its IUPAC name is N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine
PubChem CID161111008
Molecular FormulaC175H127N5O2
Molecular Weight2331.97 g/mol
Exact Mass2330.00
IUPAC NameN-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine
SMILESC1=CC2c3ccccc3N(c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)cc3)C2C=C1.C1=CC2c3ccccc3N(c3ccc(N(c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)c4cccc(-c5ccccc5)c4)cc3)C2C=C1.c1cc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3cc(-c4ccc5oc6ccccc6c5c4)ccc3c2)cc(C2(C3CCCCC3)c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C65H47NO2.2C55H40N2/c1-2-13-48(14-3-1)65(59-21-8-4-17-53(59)54-18-5-9-22-60(54)65)49-15-12-16-51(41-49)66(50-32-27-42(28-33-50)46-30-35-63-57(39-46)55-19-6-10-23-61(55)67-63)52-34-29-44-37-43(25-26-45(44)38-52)47-31-36-64-58(40-47)56-20-7-11-24-62(56)68-64;1-3-16-39(17-4-1)40-18-15-21-46(38-40)56(44-34-36-45(37-35-44)57-53-28-13-9-24-49(53)50-25-10-14-29-54(50)57)43-32-30-42(31-33-43)55(41-19-5-2-6-20-41)51-26-11-7-22-47(51)48-23-8-12-27-52(48)55;1-3-15-39(16-4-1)40-27-31-43(32-28-40)56(45-35-37-46(38-36-45)57-53-25-13-9-21-49(53)50-22-10-14-26-54(50)57)44-33-29-42(30-34-44)55(41-17-5-2-6-18-41)51-23-11-7-19-47(51)48-20-8-12-24-52(48)55/h4-12,15-41,48H,1-3,13-14H2;2*1-38,49,53H
InChIKeyUJRNOZUHGGINSW-UHFFFAOYSA-N
XLogP46.17
TPSA42.48 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds21
Heavy Atoms182
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002331.97
LogP ≤ 546.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine?
The IUPAC name of N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine (CID 161111008) is N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine?
The canonical SMILES for N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine is C1=CC2c3ccccc3N(c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)cc3)C2C=C1.C1=CC2c3ccccc3N(c3ccc(N(c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)c4cccc(-c5ccccc5)c4)cc3)C2C=C1.c1cc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3cc(-c4ccc5oc6ccccc6c5c4)ccc3c2)cc(C2(C3CCCCC3)c3ccccc3-c3ccccc32)c1.
What is the InChIKey of N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine?
The InChIKey is UJRNOZUHGGINSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H47NO2.2C55H40N2/c1-2-13-48(14-3-1)65(59-21-8-4-17-53(59)54-18-5-9-22-60(54)65)49-15-12-16-51(41-49)66(50-32-27-42(28-33-50)46-30-35-63-57(39-46)55-19-6-10-23-61(55)67-63)52-34-29-44-37-43(25-26-45(44)38-52)47-31-36-64-58(40-47)56-20-7-11-24-62(56)68-64;1-3-16-39(17-4-1)40-18-15-21-46(38-40)56(44-34-36-45(37-35-44)57-53-28-13-9-24-49(53)50-25-10-14-29-54(50)57)43-32-30-42(31-33-43)55(41-19-5-2-6-20-41)51-26-11-7-22-47(51)48-23-8-12-27-52(48)55;1-3-15-39(16-4-1)40-27-31-43(32-28-40)56(45-35-37-46(38-36-45)57-53-25-13-9-21-49(53)50-22-10-14-26-54(50)57)44-33-29-42(30-34-44)55(41-17-5-2-6-18-41)51-23-11-7-19-47(51)48-20-8-12-24-52(48)55/h4-12,15-41,48H,1-3,13-14H2;2*1-38,49,53H.
What are the key properties of N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine?
N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine has a molecular weight of 2331.97 g/mol, XLogP of 46.17, 21 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[4-(4a,9a-dihydrocarbazol-9-yl)phenyl]-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-[3-(9-cyclohexylfluoren-9-yl)phenyl]-6-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)naphthalen-2-amine is sourced from PubChem (CID 161111008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).