9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine

C62H43NO2 — CID 122595299

IUPAC9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccccc1-c1ccccc1Oc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc4oc5ccccc5c4c2)c2ccccc2-3)cc1
InChIInChI=1S/C62H43NO2/c1-42-16-8-9-21-51(42)54-23-11-14-26-59(54)64-50-36-33-48(34-37-50)63(47-31-28-44(29-32-47)43-17-4-2-5-18-43)49-35-38-53-52-22-10-13-25-57(52)62(58(53)41-49,45-19-6-3-7-20-45)46-30-39-61-56(40-46)55-24-12-15-27-60(55)65-61/h2-41H,1H3
InChIKeyXGVCQRIYWZWSIV-UHFFFAOYSA-N
MW834.03 g/mol
LogP16.85
Rot. Bonds9

About 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine

9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 122595299) has the molecular formula C62H43NO2 and a molecular weight of 834.03 g/mol. Its IUPAC name is 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID122595299
Molecular FormulaC62H43NO2
Molecular Weight834.03 g/mol
Exact Mass833.33
IUPAC Name9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
SMILESCc1ccccc1-c1ccccc1Oc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc4oc5ccccc5c4c2)c2ccccc2-3)cc1
InChIInChI=1S/C62H43NO2/c1-42-16-8-9-21-51(42)54-23-11-14-26-59(54)64-50-36-33-48(34-37-50)63(47-31-28-44(29-32-47)43-17-4-2-5-18-43)49-35-38-53-52-22-10-13-25-57(52)62(58(53)41-49,45-19-6-3-7-20-45)46-30-39-61-56(40-46)55-24-12-15-27-60(55)65-61/h2-41H,1H3
InChIKeyXGVCQRIYWZWSIV-UHFFFAOYSA-N
XLogP16.85
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500834.03
LogP ≤ 516.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(9-dibenzofuran-2-yl-9-phenylfluoren-2-yl)-N,9,9-triphenylfluoren-2-amine
CID 134452942
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 121381687
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-3-(4-phenylphenyl)aniline
CID 121381640
9-dibenzofuran-3-yl-N,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-(9-dibenzofuran-2-yl-9-phenylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-3-amine;9-dibenzofuran-3-yl-N,N,9-triphenylfluoren-2-amine
CID 157052053
N-(9,9-dimethylfluoren-2-yl)-N-[4-[8-(9-phenylfluoren-9-yl)dibenzofuran-3-yl]phenyl]dibenzofuran-3-amine;N-phenyl-N-[4-[8-(9-phenylfluoren-9-yl)dibenzofuran-3-yl]phenyl]dibenzofuran-3-amine
CID 163494653
N-(4-dibenzofuran-2-ylphenyl)-N-(2,6-diphenylphenyl)-9,9-diphenylfluoren-2-amine
CID 122675340
N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 67964095
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine
CID 121423673
N-[4-(9-dibenzofuran-2-ylfluoren-9-yl)phenyl]-4-naphthalen-2-yl-N-phenylaniline
CID 118004616
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-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 159318971
N-(9,9-diphenylfluoren-2-yl)-16-phenyl-N-(4-phenylphenyl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-amine
CID 171050339

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine (CID 122595299) is 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine is Cc1ccccc1-c1ccccc1Oc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc4oc5ccccc5c4c2)c2ccccc2-3)cc1.
What is the InChIKey of 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is XGVCQRIYWZWSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H43NO2/c1-42-16-8-9-21-51(42)54-23-11-14-26-59(54)64-50-36-33-48(34-37-50)63(47-31-28-44(29-32-47)43-17-4-2-5-18-43)49-35-38-53-52-22-10-13-25-57(52)62(58(53)41-49,45-19-6-3-7-20-45)46-30-39-61-56(40-46)55-24-12-15-27-60(55)65-61/h2-41H,1H3.
What are the key properties of 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?
9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 834.03 g/mol, XLogP of 16.85, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-2-yl-N-[4-[2-(2-methylphenyl)phenoxy]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 122595299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).