N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine

C174H116N4O — CID 165075228

IUPACN-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c3ccc4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C61H40N2.C58H41N.C55H35NO/c1-2-15-41(16-3-1)42-29-33-44(34-30-42)62(46-37-39-47(40-38-46)63-58-27-12-7-19-51(58)52-20-8-13-28-59(52)63)45-35-31-43(32-36-45)48-22-14-26-57-60(48)53-21-6-11-25-56(53)61(57)54-23-9-4-17-49(54)50-18-5-10-24-55(50)61;1-57(2)50-22-10-6-17-45(50)48-36-35-43(37-55(48)57)59(41-31-27-39(28-32-41)38-15-4-3-5-16-38)42-33-29-40(30-34-42)44-21-14-26-54-56(44)49-20-9-13-25-53(49)58(54)51-23-11-7-18-46(51)47-19-8-12-24-52(47)58;1-2-13-36(14-3-1)37-25-29-39(30-26-37)56(41-33-34-53-47(35-41)45-17-7-11-24-52(45)57-53)40-31-27-38(28-32-40)42-19-12-23-51-54(42)46-18-6-10-22-50(46)55(51)48-20-8-4-15-43(48)44-16-5-9-21-49(44)55/h1-40H;3-37H,1-2H3;1-35H
InChIKeyUETYNRCUPGMENM-UHFFFAOYSA-N
MW2278.87 g/mol
LogP45.80
Rot. Bonds16

About N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine

N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine (PubChem CID 165075228) has the molecular formula C174H116N4O and a molecular weight of 2278.87 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine
PubChem CID165075228
Molecular FormulaC174H116N4O
Molecular Weight2278.87 g/mol
Exact Mass2276.91
IUPAC NameN-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c3ccc4oc5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C61H40N2.C58H41N.C55H35NO/c1-2-15-41(16-3-1)42-29-33-44(34-30-42)62(46-37-39-47(40-38-46)63-58-27-12-7-19-51(58)52-20-8-13-28-59(52)63)45-35-31-43(32-36-45)48-22-14-26-57-60(48)53-21-6-11-25-56(53)61(57)54-23-9-4-17-49(54)50-18-5-10-24-55(50)61;1-57(2)50-22-10-6-17-45(50)48-36-35-43(37-55(48)57)59(41-31-27-39(28-32-41)38-15-4-3-5-16-38)42-33-29-40(30-34-42)44-21-14-26-54-56(44)49-20-9-13-25-53(49)58(54)51-23-11-7-18-46(51)47-19-8-12-24-52(47)58;1-2-13-36(14-3-1)37-25-29-39(30-26-37)56(41-33-34-53-47(35-41)45-17-7-11-24-52(45)57-53)40-31-27-38(28-32-40)42-19-12-23-51-54(42)46-18-6-10-22-50(46)55(51)48-20-8-4-15-43(48)44-16-5-9-21-49(44)55/h1-40H;3-37H,1-2H3;1-35H
InChIKeyUETYNRCUPGMENM-UHFFFAOYSA-N
XLogP45.80
TPSA27.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms179
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002278.87
LogP ≤ 545.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine (CID 165075228) is N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c3ccc4oc5ccccc5c4c3)cc2)cc1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine?
The InChIKey is UETYNRCUPGMENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H40N2.C58H41N.C55H35NO/c1-2-15-41(16-3-1)42-29-33-44(34-30-42)62(46-37-39-47(40-38-46)63-58-27-12-7-19-51(58)52-20-8-13-28-59(52)63)45-35-31-43(32-36-45)48-22-14-26-57-60(48)53-21-6-11-25-56(53)61(57)54-23-9-4-17-49(54)50-18-5-10-24-55(50)61;1-57(2)50-22-10-6-17-45(50)48-36-35-43(37-55(48)57)59(41-31-27-39(28-32-41)38-15-4-3-5-16-38)42-33-29-40(30-34-42)44-21-14-26-54-56(44)49-20-9-13-25-53(49)58(54)51-23-11-7-18-46(51)47-19-8-12-24-52(47)58;1-2-13-36(14-3-1)37-25-29-39(30-26-37)56(41-33-34-53-47(35-41)45-17-7-11-24-52(45)57-53)40-31-27-38(28-32-40)42-19-12-23-51-54(42)46-18-6-10-22-50(46)55(51)48-20-8-4-15-43(48)44-16-5-9-21-49(44)55/h1-40H;3-37H,1-2H3;1-35H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine?
N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine has a molecular weight of 2278.87 g/mol, XLogP of 45.80, 16 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine is sourced from PubChem (CID 165075228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).