N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine

C70H50N2O — CID 167214760

IUPACN-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc5c(c4)c4cc(C6(c7ccccc7)c7ccccc7-c7ccccc76)ccc4n5-c4ccccc4)cc3)c3ccc4c5c(oc4c3)C=CCC5)ccc21
InChIInChI=1S/C70H50N2O/c1-69(2)61-25-13-9-23-55(61)58-43-51(36-38-62(58)69)71(52-35-37-57-56-24-12-16-28-67(56)73-68(57)44-52)50-33-29-45(30-34-50)46-31-39-65-59(41-46)60-42-48(32-40-66(60)72(65)49-19-7-4-8-20-49)70(47-17-5-3-6-18-47)63-26-14-10-21-53(63)54-22-11-15-27-64(54)70/h3-11,13-23,25-44H,12,24H2,1-2H3
InChIKeyFJFLNBPJXVQQNN-UHFFFAOYSA-N
MW935.18 g/mol
LogP18.30
Rot. Bonds7

About N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine

N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine (PubChem CID 167214760) has the molecular formula C70H50N2O and a molecular weight of 935.18 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine
PubChem CID167214760
Molecular FormulaC70H50N2O
Molecular Weight935.18 g/mol
Exact Mass934.39
IUPAC NameN-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc5c(c4)c4cc(C6(c7ccccc7)c7ccccc7-c7ccccc76)ccc4n5-c4ccccc4)cc3)c3ccc4c5c(oc4c3)C=CCC5)ccc21
InChIInChI=1S/C70H50N2O/c1-69(2)61-25-13-9-23-55(61)58-43-51(36-38-62(58)69)71(52-35-37-57-56-24-12-16-28-67(56)73-68(57)44-52)50-33-29-45(30-34-50)46-31-39-65-59(41-46)60-42-48(32-40-66(60)72(65)49-19-7-4-8-20-49)70(47-17-5-3-6-18-47)63-26-14-10-21-53(63)54-22-11-15-27-64(54)70/h3-11,13-23,25-44H,12,24H2,1-2H3
InChIKeyFJFLNBPJXVQQNN-UHFFFAOYSA-N
XLogP18.30
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms73
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500935.18
LogP ≤ 518.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]dibenzofuran-2-amine
CID 167214769
N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 167215045
N-[4-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-N-(9,9'-spirobi[fluorene]-3-yl)dibenzofuran-3-amine
CID 126702849
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[9-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-yl]phenyl]fluoren-2-amine
CID 167334138
N-[4-(8,9-dihydrodibenzofuran-2-yl)phenyl]-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-3-phenylaniline
CID 156826935
N-(9,9-diphenylfluoren-2-yl)-N-[4-[9-phenyl-6-(9-phenyl-3,4-dihydrofluoren-9-yl)carbazol-3-yl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 167214987
N-(9,9-dimethylfluoren-3-yl)-9,9-diphenyl-N-[2,3,5,6-tetradeuterio-4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 167334044
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-3'-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-3'-amine
CID 157239139
9,9-diphenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 167214675
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine;9,9-dimethyl-N-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-7-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzofuran-3-amine;N,4-diphenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]aniline;4-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)aniline;N,9,9-triphenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine
CID 158028209
4-phenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-6-[4-(9-phenylfluoren-9-yl)phenyl]carbazol-3-yl]phenyl]aniline
CID 167334212
N-(9,9-dimethylfluoren-2-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]phenanthren-2-amine
CID 167214737

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine?
The IUPAC name of N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine (CID 167214760) is N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine is CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc5c(c4)c4cc(C6(c7ccccc7)c7ccccc7-c7ccccc76)ccc4n5-c4ccccc4)cc3)c3ccc4c5c(oc4c3)C=CCC5)ccc21.
What is the InChIKey of N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine?
The InChIKey is FJFLNBPJXVQQNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H50N2O/c1-69(2)61-25-13-9-23-55(61)58-43-51(36-38-62(58)69)71(52-35-37-57-56-24-12-16-28-67(56)73-68(57)44-52)50-33-29-45(30-34-50)46-31-39-65-59(41-46)60-42-48(32-40-66(60)72(65)49-19-7-4-8-20-49)70(47-17-5-3-6-18-47)63-26-14-10-21-53(63)54-22-11-15-27-64(54)70/h3-11,13-23,25-44H,12,24H2,1-2H3.
What are the key properties of N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine?
N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine has a molecular weight of 935.18 g/mol, XLogP of 18.30, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]-8,9-dihydrodibenzofuran-3-amine is sourced from PubChem (CID 167214760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).