[7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol

C57H41NO — CID 139983986

IUPAC[7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol
SMILESOCc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)ccc1-2
InChIInChI=1S/C57H41NO/c59-39-40-30-33-49-51-35-32-47(38-55(51)57(53(49)36-40,43-22-10-3-11-23-43)44-24-12-4-13-25-44)58(45-26-14-5-15-27-45)46-31-34-50-48-28-16-17-29-52(48)56(54(50)37-46,41-18-6-1-7-19-41)42-20-8-2-9-21-42/h1-38,59H,39H2
InChIKeyRTWWPQBFKZEUSM-UHFFFAOYSA-N
MW755.96 g/mol
LogP13.37
Rot. Bonds8

About [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol

[7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol (PubChem CID 139983986) has the molecular formula C57H41NO and a molecular weight of 755.96 g/mol. Its IUPAC name is [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol.

Molecular Properties

Compound Name[7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol
PubChem CID139983986
Molecular FormulaC57H41NO
Molecular Weight755.96 g/mol
Exact Mass755.32
IUPAC Name[7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol
SMILESOCc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)ccc1-2
InChIInChI=1S/C57H41NO/c59-39-40-30-33-49-51-35-32-47(38-55(51)57(53(49)36-40,43-22-10-3-11-23-43)44-24-12-4-13-25-44)58(45-26-14-5-15-27-45)46-31-34-50-48-28-16-17-29-52(48)56(54(50)37-46,41-18-6-1-7-19-41)42-20-8-2-9-21-42/h1-38,59H,39H2
InChIKeyRTWWPQBFKZEUSM-UHFFFAOYSA-N
XLogP13.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500755.96
LogP ≤ 513.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,3-N,5-N-tris(9,9-diphenylfluoren-2-yl)-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 132601190
N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 86198899
N-(9,9-diphenylfluoren-2-yl)-9,9-diphenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 118298160
[4-(N-(9,9-diphenylfluoren-2-yl)anilino)phenyl]boronic acid
CID 123393437
N-(4-chlorophenyl)-N,9,9-triphenylfluoren-2-amine
CID 139762369
N-[9-(4-tert-butylphenyl)-9-phenylfluoren-2-yl]-2',7'-diethyl-N-phenyl-9,9'-spirobi[fluorene]-2-amine
CID 177067096
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
N,N-bis(4-octylphenyl)-9,9-diphenylfluoren-2-amine
CID 139762426
4-[bis(9,9-diphenylfluoren-2-yl)amino]benzoic acid
CID 139978935
5-bromo-1-N,3-N-bis(9,9-diphenylfluoren-2-yl)-1-N,3-N-diphenylbenzene-1,3-diamine
CID 88867924
6-N,16-N-bis(9,9-diphenylfluoren-2-yl)-6-N,16-N-diphenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaene-6,16-diamine
CID 166033580
N-(9,9-diphenylfluoren-2-yl)-N-phenylspiro[benzo[b]fluorene-11,9'-fluorene]-2-amine
CID 134193981

Frequently Asked Questions

What is the IUPAC name of [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol?
The IUPAC name of [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol (CID 139983986) is [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol.
What is the SMILES notation for [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol?
The canonical SMILES for [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol is OCc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)ccc1-2.
What is the InChIKey of [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol?
The InChIKey is RTWWPQBFKZEUSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H41NO/c59-39-40-30-33-49-51-35-32-47(38-55(51)57(53(49)36-40,43-22-10-3-11-23-43)44-24-12-4-13-25-44)58(45-26-14-5-15-27-45)46-31-34-50-48-28-16-17-29-52(48)56(54(50)37-46,41-18-6-1-7-19-41)42-20-8-2-9-21-42/h1-38,59H,39H2.
What are the key properties of [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol?
[7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol has a molecular weight of 755.96 g/mol, XLogP of 13.37, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [7-(N-(9,9-diphenylfluoren-2-yl)anilino)-9,9-diphenylfluoren-2-yl]methanol is sourced from PubChem (CID 139983986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).