N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine

C74H49NO — CID 176759723

IUPACN-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2cccc(C3(c4cccc(N(c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)c5cccc6oc7ccc(-c8ccccc8)cc7c56)c4)c4ccccc4-c4ccccc43)c2)cc1
InChIInChI=1S/C74H49NO/c1-5-22-50(23-6-1)52-26-19-31-56(46-52)74(66-38-17-13-34-60(66)61-35-14-18-39-67(61)74)57-32-20-33-58(48-57)75(69-40-21-41-71-72(69)64-47-53(42-45-70(64)76-71)51-24-7-2-8-25-51)59-43-44-63-62-36-15-16-37-65(62)73(68(63)49-59,54-27-9-3-10-28-54)55-29-11-4-12-30-55/h1-49H
InChIKeyUZSSKXDSOVFIBB-UHFFFAOYSA-N
MW968.21 g/mol
LogP19.12
Rot. Bonds9

About N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine

N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine (PubChem CID 176759723) has the molecular formula C74H49NO and a molecular weight of 968.21 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
PubChem CID176759723
Molecular FormulaC74H49NO
Molecular Weight968.21 g/mol
Exact Mass967.38
IUPAC NameN-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2cccc(C3(c4cccc(N(c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)c5cccc6oc7ccc(-c8ccccc8)cc7c56)c4)c4ccccc4-c4ccccc43)c2)cc1
InChIInChI=1S/C74H49NO/c1-5-22-50(23-6-1)52-26-19-31-56(46-52)74(66-38-17-13-34-60(66)61-35-14-18-39-67(61)74)57-32-20-33-58(48-57)75(69-40-21-41-71-72(69)64-47-53(42-45-70(64)76-71)51-24-7-2-8-25-51)59-43-44-63-62-36-15-16-37-65(62)73(68(63)49-59,54-27-9-3-10-28-54)55-29-11-4-12-30-55/h1-49H
InChIKeyUZSSKXDSOVFIBB-UHFFFAOYSA-N
XLogP19.12
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500968.21
LogP ≤ 519.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-phenyl-N-(3-phenylphenyl)-N-[4-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759838
N-(4-dibenzofuran-1-ylphenyl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759950
N-(9,9-dimethyl-5-phenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759880
N-phenyl-N-(4-phenylphenyl)-8-[9-(4-phenylphenyl)fluoren-9-yl]dibenzofuran-1-amine
CID 163681080
N-[4-(2,6-ditert-butylphenyl)phenyl]-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759722
8-phenyl-N-(9-phenyldibenzothiophen-2-yl)-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-1-amine
CID 170045111
N-dibenzothiophen-4-yl-N-[3-(2,9-diphenylfluoren-9-yl)phenyl]-8-phenyldibenzofuran-1-amine
CID 176759746
N-(8-phenyldibenzofuran-1-yl)-N-[3-(9-phenylfluoren-9-yl)phenyl]spiro[fluorene-9,9'-xanthene]-4-amine
CID 176759987
8-phenyl-N-(9-phenyldibenzothiophen-2-yl)-N-[3-[9-(4-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759756
N-(3-phenylphenyl)-N-(2-phenyl-9,9'-spirobi[fluorene]-2'-yl)dibenzofuran-1-amine
CID 138717049
N-[8-[4-(1-adamantyl)phenyl]dibenzofuran-1-yl]-9-phenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-2-amine
CID 176759710
N-(4-phenylphenyl)-N-(7'-phenyl-9,9'-spirobi[fluorene]-2'-yl)dibenzofuran-1-amine
CID 138717047

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine (CID 176759723) is N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine is c1ccc(-c2cccc(C3(c4cccc(N(c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)c5cccc6oc7ccc(-c8ccccc8)cc7c56)c4)c4ccccc4-c4ccccc43)c2)cc1.
What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
The InChIKey is UZSSKXDSOVFIBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H49NO/c1-5-22-50(23-6-1)52-26-19-31-56(46-52)74(66-38-17-13-34-60(66)61-35-14-18-39-67(61)74)57-32-20-33-58(48-57)75(69-40-21-41-71-72(69)64-47-53(42-45-70(64)76-71)51-24-7-2-8-25-51)59-43-44-63-62-36-15-16-37-65(62)73(68(63)49-59,54-27-9-3-10-28-54)55-29-11-4-12-30-55/h1-49H.
What are the key properties of N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine has a molecular weight of 968.21 g/mol, XLogP of 19.12, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine is sourced from PubChem (CID 176759723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).