9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine

C68H47N — CID 140919853

IUPAC9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3-4)c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C68H47N/c1-6-22-48(23-7-1)49-38-41-55(42-39-49)69(66-37-21-18-32-57(66)50-24-8-2-9-25-50)56-43-45-61-60-44-40-54(46-64(60)67(65(61)47-56,51-26-10-3-11-27-51)52-28-12-4-13-29-52)68(53-30-14-5-15-31-53)62-35-19-16-33-58(62)59-34-17-20-36-63(59)68/h1-47H
InChIKeyJVFBUXLPNVIILV-UHFFFAOYSA-N
MW878.13 g/mol
LogP17.22
Rot. Bonds9

About 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine

9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 140919853) has the molecular formula C68H47N and a molecular weight of 878.13 g/mol. Its IUPAC name is 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
PubChem CID140919853
Molecular FormulaC68H47N
Molecular Weight878.13 g/mol
Exact Mass877.37
IUPAC Name9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3-4)c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C68H47N/c1-6-22-48(23-7-1)49-38-41-55(42-39-49)69(66-37-21-18-32-57(66)50-24-8-2-9-25-50)56-43-45-61-60-44-40-54(46-64(60)67(65(61)47-56,51-26-10-3-11-27-51)52-28-12-4-13-29-52)68(53-30-14-5-15-31-53)62-35-19-16-33-58(62)59-34-17-20-36-63(59)68/h1-47H
InChIKeyJVFBUXLPNVIILV-UHFFFAOYSA-N
XLogP17.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500878.13
LogP ≤ 517.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,4-diphenylphenyl)-9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)fluoren-2-amine
CID 140919885
9,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]-N-(2-phenylphenyl)fluoren-2-amine
CID 121464349
9,9-diphenyl-N-(2-phenylphenyl)-N-[2,3,5,6-tetradeuterio-4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 171451168
N-[4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 142481346
9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-9-[4-(trimethyl-λ4-sulfanyl)phenyl]fluoren-2-amine
CID 144558373
N-(9,9-diphenylfluoren-2-yl)-N-(2-phenylphenyl)tetraphenylen-2-amine
CID 139297876
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
N-[4-(9-phenylfluoren-9-yl)phenyl]-N,3-bis(4-phenylphenyl)aniline;2-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[3-(4-phenylphenyl)phenyl]aniline;3-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[3-(4-phenylphenyl)phenyl]aniline
CID 158825710
ethane;2-N,7-N,9,9-tetraphenyl-2-N,7-N-bis(2-phenylphenyl)fluorene-2,7-diamine
CID 160845132
N-[3-(9,9-diphenylfluoren-3-yl)phenyl]-9,9-diphenyl-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121423779
N-[7-[3-[3-[2-(N-[9,9-dimethyl-7-[4-(4-phenylphenyl)phenyl]fluoren-2-yl]-2-phenylanilino)-9-phenylfluoren-9-yl]phenyl]phenyl]-9,9-diphenylfluoren-2-yl]-9,9-dimethyl-N-(2-phenylphenyl)-7-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 139469384
N-(9,9-diphenylfluoren-2-yl)-N-[2-(3-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 118298454

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine (CID 140919853) is 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cc(C5(c6ccccc6)c6ccccc6-c6ccccc65)ccc3-4)c3ccccc3-c3ccccc3)cc2)cc1.
What is the InChIKey of 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
The InChIKey is JVFBUXLPNVIILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H47N/c1-6-22-48(23-7-1)49-38-41-55(42-39-49)69(66-37-21-18-32-57(66)50-24-8-2-9-25-50)56-43-45-61-60-44-40-54(46-64(60)67(65(61)47-56,51-26-10-3-11-27-51)52-28-12-4-13-29-52)68(53-30-14-5-15-31-53)62-35-19-16-33-58(62)59-34-17-20-36-63(59)68/h1-47H.
What are the key properties of 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine?
9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 878.13 g/mol, XLogP of 17.22, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-7-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 140919853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).