9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine

C76H56N2O — CID 170138429

IUPAC9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine
SMILESCC1(C)C2=C(C=CCC2)c2c(-c3ccccc3N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)C(c3ccccc3)(c3ccc5oc6ccccc6c5c3)C3C=CC=CC43)cccc21
InChIInChI=1S/C76H56N2O/c1-75(2)65-33-14-10-31-63(65)74-62(32-20-35-67(74)75)59-29-12-16-36-69(59)77(54-26-19-21-49(45-54)50-39-42-60-58-28-11-17-37-70(58)78(71(60)46-50)53-24-7-4-8-25-53)55-41-43-57-56-27-9-15-34-66(56)76(68(57)48-55,51-22-5-3-6-23-51)52-40-44-73-64(47-52)61-30-13-18-38-72(61)79-73/h3-13,15-32,34-48,56,66H,14,33H2,1-2H3
InChIKeyVDEQSGZEEFCCNC-UHFFFAOYSA-N
MW1013.30 g/mol
LogP20.06
Rot. Bonds8

About 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine

9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine (PubChem CID 170138429) has the molecular formula C76H56N2O and a molecular weight of 1013.30 g/mol. Its IUPAC name is 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine.

Molecular Properties

Compound Name9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine
PubChem CID170138429
Molecular FormulaC76H56N2O
Molecular Weight1013.30 g/mol
Exact Mass1012.44
IUPAC Name9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine
SMILESCC1(C)C2=C(C=CCC2)c2c(-c3ccccc3N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)C(c3ccccc3)(c3ccc5oc6ccccc6c5c3)C3C=CC=CC43)cccc21
InChIInChI=1S/C76H56N2O/c1-75(2)65-33-14-10-31-63(65)74-62(32-20-35-67(74)75)59-29-12-16-36-69(59)77(54-26-19-21-49(45-54)50-39-42-60-58-28-11-17-37-70(58)78(71(60)46-50)53-24-7-4-8-25-53)55-41-43-57-56-27-9-15-34-66(56)76(68(57)48-55,51-22-5-3-6-23-51)52-40-44-73-64(47-52)61-30-13-18-38-72(61)79-73/h3-13,15-32,34-48,56,66H,14,33H2,1-2H3
InChIKeyVDEQSGZEEFCCNC-UHFFFAOYSA-N
XLogP20.06
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms79
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001013.30
LogP ≤ 520.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine with MolForge

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Related Compounds

N-(3-dibenzofuran-3-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9-phenylcarbazol-2-amine
CID 170139036
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]fluoren-3-amine
CID 170138428
2-(9,9-dimethylfluoren-4-yl)-N-[3-(9-phenylcarbazol-2-yl)phenyl]-N-[2-(2-phenylphenyl)phenyl]aniline
CID 170137615
N-(2-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-3-yl)-9,9-dimethylfluoren-1-amine;N-(9,9-dimethylfluoren-3-yl)-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-1-amine;N-(9,9-dimethylfluoren-3-yl)-9,9-dimethyl-N-[3-(9-phenylcarbazol-1-yl)phenyl]fluoren-1-amine;N-(9,9-dimethylfluoren-3-yl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-1-amine
CID 162176286
N-(3-dibenzofuran-2-ylphenyl)-N-[3-(9-phenylcarbazol-3-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170298779
N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine
CID 129180885
N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 159673731
N-(9,9-diphenyl-4b,8a-dihydrofluoren-2-yl)-N-naphthalen-2-yl-9-phenylcarbazol-2-amine
CID 164778272
N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-(9-phenylcarbazol-2-yl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 89213188
N-(3-carbazol-9-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 121424581
N-(3-dibenzofuran-2-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-2-phenylaniline
CID 170139631
N,N-di(dibenzofuran-1-yl)-8-(9-phenylcarbazol-3-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 165103115

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine?
The IUPAC name of 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine (CID 170138429) is 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine.
What is the SMILES notation for 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine?
The canonical SMILES for 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine is CC1(C)C2=C(C=CCC2)c2c(-c3ccccc3N(c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c3)c3ccc4c(c3)C(c3ccccc3)(c3ccc5oc6ccccc6c5c3)C3C=CC=CC43)cccc21.
What is the InChIKey of 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine?
The InChIKey is VDEQSGZEEFCCNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H56N2O/c1-75(2)65-33-14-10-31-63(65)74-62(32-20-35-67(74)75)59-29-12-16-36-69(59)77(54-26-19-21-49(45-54)50-39-42-60-58-28-11-17-37-70(58)78(71(60)46-50)53-24-7-4-8-25-53)55-41-43-57-56-27-9-15-34-66(56)76(68(57)48-55,51-22-5-3-6-23-51)52-40-44-73-64(47-52)61-30-13-18-38-72(61)79-73/h3-13,15-32,34-48,56,66H,14,33H2,1-2H3.
What are the key properties of 9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine?
9-dibenzofuran-2-yl-N-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine has a molecular weight of 1013.30 g/mol, XLogP of 20.06, 8 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-[2-(9,9-dimethyl-7,8-dihydrofluoren-4-yl)phenyl]-9-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-4b,8a-dihydrofluoren-2-amine is sourced from PubChem (CID 170138429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).