N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine

C73H47NO2 — CID 121425112

IUPACN-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)c4ccc(-c5cccc(-c6ccc7oc8ccccc8c7c6)c5)cc4)ccc32)cc1
InChIInChI=1S/C73H47NO2/c1-3-16-56(17-4-1)73(57-18-5-2-6-19-57)67-23-10-7-20-61(67)64-47-60(40-41-68(64)73)74(58-36-30-49(31-37-58)48-26-28-50(29-27-48)54-34-42-71-65(45-54)62-21-8-11-24-69(62)75-71)59-38-32-51(33-39-59)52-14-13-15-53(44-52)55-35-43-72-66(46-55)63-22-9-12-25-70(63)76-72/h1-47H
InChIKeyDSMVQQOAZAZLDI-UHFFFAOYSA-N
MW970.18 g/mol
LogP19.99
Rot. Bonds9

About N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine

N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine (PubChem CID 121425112) has the molecular formula C73H47NO2 and a molecular weight of 970.18 g/mol. Its IUPAC name is N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine.

Molecular Properties

Compound NameN-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
PubChem CID121425112
Molecular FormulaC73H47NO2
Molecular Weight970.18 g/mol
Exact Mass969.36
IUPAC NameN-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)c4ccc(-c5cccc(-c6ccc7oc8ccccc8c7c6)c5)cc4)ccc32)cc1
InChIInChI=1S/C73H47NO2/c1-3-16-56(17-4-1)73(57-18-5-2-6-19-57)67-23-10-7-20-61(67)64-47-60(40-41-68(64)73)74(58-36-30-49(31-37-58)48-26-28-50(29-27-48)54-34-42-71-65(45-54)62-21-8-11-24-69(62)75-71)59-38-32-51(33-39-59)52-14-13-15-53(44-52)55-35-43-72-66(46-55)63-22-9-12-25-70(63)76-72/h1-47H
InChIKeyDSMVQQOAZAZLDI-UHFFFAOYSA-N
XLogP19.99
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500970.18
LogP ≤ 519.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
CID 121425114
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine
CID 121423673
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-3-(4-phenylphenyl)aniline
CID 121381640
9,9-diphenyl-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]fluoren-3-amine
CID 168805222
N-(4-dibenzofuran-2-ylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-3-amine
CID 126538337
N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-3-(9,9-diphenylfluoren-3-yl)aniline
CID 121424769
3-N-dibenzofuran-2-yl-3-N-[3-(9-phenylfluoren-9-yl)phenyl]-1-N-(3-phenylphenyl)-1-N-(4-phenylphenyl)benzene-1,3-diamine
CID 155096723
N-(4-dibenzofuran-3-ylphenyl)-3-[4-(9,9-diphenylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 168840154
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 121381687
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 157370193
N-(4-dibenzofuran-2-ylphenyl)-N-(2,6-diphenylphenyl)-9,9-diphenylfluoren-2-amine
CID 122675340
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-2-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 121424697

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine?
The IUPAC name of N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine (CID 121425112) is N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine.
What is the SMILES notation for N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine?
The canonical SMILES for N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc4)c4ccc(-c5cccc(-c6ccc7oc8ccccc8c7c6)c5)cc4)ccc32)cc1.
What is the InChIKey of N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine?
The InChIKey is DSMVQQOAZAZLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H47NO2/c1-3-16-56(17-4-1)73(57-18-5-2-6-19-57)67-23-10-7-20-61(67)64-47-60(40-41-68(64)73)74(58-36-30-49(31-37-58)48-26-28-50(29-27-48)54-34-42-71-65(45-54)62-21-8-11-24-69(62)75-71)59-38-32-51(33-39-59)52-14-13-15-53(44-52)55-35-43-72-66(46-55)63-22-9-12-25-70(63)76-72/h1-47H.
What are the key properties of N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine?
N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine has a molecular weight of 970.18 g/mol, XLogP of 19.99, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine is sourced from PubChem (CID 121425112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).