N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine

C56H46N2O — CID 170277224

IUPACN-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine
SMILESCC1(C)CCC(C)(C)c2cc(-n3c4ccccc4c4ccc(N(c5ccc(-c6cccc7oc8ccccc8c67)cc5)c5ccccc5-c5ccccc5)cc43)ccc21
InChIInChI=1S/C56H46N2O/c1-55(2)33-34-56(3,4)48-35-40(30-32-47(48)55)58-50-22-12-9-18-44(50)45-31-29-41(36-51(45)58)57(49-21-11-8-17-42(49)37-15-6-5-7-16-37)39-27-25-38(26-28-39)43-20-14-24-53-54(43)46-19-10-13-23-52(46)59-53/h5-32,35-36H,33-34H2,1-4H3
InChIKeyOJDNILQFIUIOOS-UHFFFAOYSA-N
MW763.00 g/mol
LogP15.84
Rot. Bonds6

About N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine

N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine (PubChem CID 170277224) has the molecular formula C56H46N2O and a molecular weight of 763.00 g/mol. Its IUPAC name is N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine
PubChem CID170277224
Molecular FormulaC56H46N2O
Molecular Weight763.00 g/mol
Exact Mass762.36
IUPAC NameN-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine
SMILESCC1(C)CCC(C)(C)c2cc(-n3c4ccccc4c4ccc(N(c5ccc(-c6cccc7oc8ccccc8c67)cc5)c5ccccc5-c5ccccc5)cc43)ccc21
InChIInChI=1S/C56H46N2O/c1-55(2)33-34-56(3,4)48-35-40(30-32-47(48)55)58-50-22-12-9-18-44(50)45-31-29-41(36-51(45)58)57(49-21-11-8-17-42(49)37-15-6-5-7-16-37)39-27-25-38(26-28-39)43-20-14-24-53-54(43)46-19-10-13-23-52(46)59-53/h5-32,35-36H,33-34H2,1-4H3
InChIKeyOJDNILQFIUIOOS-UHFFFAOYSA-N
XLogP15.84
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500763.00
LogP ≤ 515.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-dibenzofuran-4-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine
CID 170277225
N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine
CID 170277086
N-(4-phenylphenyl)-N-[4-[9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-3-yl]phenyl]dibenzofuran-4-amine
CID 170279477
N-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]-N-[4-(3-dibenzofuran-1-ylphenyl)phenyl]-2-(4-phenylphenyl)aniline
CID 155398414
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)-2-(2-phenylphenyl)aniline
CID 155398224
N-(4-carbazol-9-ylphenyl)-N-(2-dibenzofuran-1-ylphenyl)-2-phenylaniline
CID 155649255
N-(4-carbazol-9-ylphenyl)-2-dibenzofuran-1-yl-N-[3-(2-phenylphenyl)phenyl]aniline
CID 155398745
N-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]-2-dibenzofuran-1-yl-N-(4-phenylphenyl)aniline
CID 155398540
N-[4-[3-(4-carbazol-9-ylphenyl)phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-(2-phenylphenyl)aniline
CID 155398519
N,9-bis(4-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 138668241
N-[4-(3-carbazol-9-ylphenyl)phenyl]-2-dibenzofuran-1-yl-N-[3-(4-phenylphenyl)phenyl]aniline
CID 155398509
N-[4-[3-(4-carbazol-9-ylphenyl)phenyl]phenyl]-2-dibenzofuran-1-yl-N-[3-(3-phenylphenyl)phenyl]aniline
CID 155398660

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine?
The IUPAC name of N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine (CID 170277224) is N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine.
What is the SMILES notation for N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine?
The canonical SMILES for N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine is CC1(C)CCC(C)(C)c2cc(-n3c4ccccc4c4ccc(N(c5ccc(-c6cccc7oc8ccccc8c67)cc5)c5ccccc5-c5ccccc5)cc43)ccc21.
What is the InChIKey of N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine?
The InChIKey is OJDNILQFIUIOOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H46N2O/c1-55(2)33-34-56(3,4)48-35-40(30-32-47(48)55)58-50-22-12-9-18-44(50)45-31-29-41(36-51(45)58)57(49-21-11-8-17-42(49)37-15-6-5-7-16-37)39-27-25-38(26-28-39)43-20-14-24-53-54(43)46-19-10-13-23-52(46)59-53/h5-32,35-36H,33-34H2,1-4H3.
What are the key properties of N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine?
N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine has a molecular weight of 763.00 g/mol, XLogP of 15.84, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)-9-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbazol-2-amine is sourced from PubChem (CID 170277224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).