N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine

C78H54N2O2 — CID 90376824

IUPACN-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine
SMILESCC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccc(-c4ccc5c(c4)C(C)(C)c4c-5ccc5oc6ccccc6c45)cc3)cc21
InChIInChI=1S/C78H54N2O2/c1-77(2)66-45-52(50-29-41-73-65(43-50)62-15-7-11-19-71(62)81-73)28-37-57(66)58-39-36-56(46-68(58)77)79(53-30-21-47(22-31-53)48-23-34-55(35-24-48)80-69-17-9-5-13-60(69)61-14-6-10-18-70(61)80)54-32-25-49(26-33-54)51-27-38-59-63-40-42-74-75(64-16-8-12-20-72(64)82-74)76(63)78(3,4)67(59)44-51/h5-46H,1-4H3
InChIKeyWNCBWHSOKBWDCC-UHFFFAOYSA-N
MW1051.30 g/mol
LogP21.67
Rot. Bonds7

About N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine

N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine (PubChem CID 90376824) has the molecular formula C78H54N2O2 and a molecular weight of 1051.30 g/mol. Its IUPAC name is N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine
PubChem CID90376824
Molecular FormulaC78H54N2O2
Molecular Weight1051.30 g/mol
Exact Mass1050.42
IUPAC NameN-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine
SMILESCC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccc(-c4ccc5c(c4)C(C)(C)c4c-5ccc5oc6ccccc6c45)cc3)cc21
InChIInChI=1S/C78H54N2O2/c1-77(2)66-45-52(50-29-41-73-65(43-50)62-15-7-11-19-71(62)81-73)28-37-57(66)58-39-36-56(46-68(58)77)79(53-30-21-47(22-31-53)48-23-34-55(35-24-48)80-69-17-9-5-13-60(69)61-14-6-10-18-70(61)80)54-32-25-49(26-33-54)51-27-38-59-63-40-42-74-75(64-16-8-12-20-72(64)82-74)76(63)78(3,4)67(59)44-51/h5-46H,1-4H3
InChIKeyWNCBWHSOKBWDCC-UHFFFAOYSA-N
XLogP21.67
TPSA34.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms82
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001051.30
LogP ≤ 521.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine (CID 90376824) is N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine is CC1(C)c2cc(-c3ccc4oc5ccccc5c4c3)ccc2-c2ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccc(-c4ccc5c(c4)C(C)(C)c4c-5ccc5oc6ccccc6c45)cc3)cc21.
What is the InChIKey of N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine?
The InChIKey is WNCBWHSOKBWDCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H54N2O2/c1-77(2)66-45-52(50-29-41-73-65(43-50)62-15-7-11-19-71(62)81-73)28-37-57(66)58-39-36-56(46-68(58)77)79(53-30-21-47(22-31-53)48-23-34-55(35-24-48)80-69-17-9-5-13-60(69)61-14-6-10-18-70(61)80)54-32-25-49(26-33-54)51-27-38-59-63-40-42-74-75(64-16-8-12-20-72(64)82-74)76(63)78(3,4)67(59)44-51/h5-46H,1-4H3.
What are the key properties of N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine?
N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine has a molecular weight of 1051.30 g/mol, XLogP of 21.67, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-carbazol-9-ylphenyl)phenyl]-7-dibenzofuran-2-yl-N-[4-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)phenyl]-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 90376824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).