N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine

C55H36N2O — CID 158192922

IUPACN,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine
SMILESc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c(C3(c4ccccc4)c4ccccc4-c4ccccc43)ccc3c2oc2ccccc23)cc1
InChIInChI=1S/C55H36N2O/c1-4-18-37(19-5-1)55(47-28-14-10-24-41(47)42-25-11-15-29-48(42)55)49-34-33-45-44-27-13-17-31-52(44)58-54(45)53(49)56(38-20-6-2-7-21-38)40-32-35-51-46(36-40)43-26-12-16-30-50(43)57(51)39-22-8-3-9-23-39/h1-36H
InChIKeyDNHOIICBIUPCLE-UHFFFAOYSA-N
MW740.91 g/mol
LogP14.52
Rot. Bonds6

About N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine

N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine (PubChem CID 158192922) has the molecular formula C55H36N2O and a molecular weight of 740.91 g/mol. Its IUPAC name is N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine.

Molecular Properties

Compound NameN,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine
PubChem CID158192922
Molecular FormulaC55H36N2O
Molecular Weight740.91 g/mol
Exact Mass740.28
IUPAC NameN,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine
SMILESc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c(C3(c4ccccc4)c4ccccc4-c4ccccc43)ccc3c2oc2ccccc23)cc1
InChIInChI=1S/C55H36N2O/c1-4-18-37(19-5-1)55(47-28-14-10-24-41(47)42-25-11-15-29-48(42)55)49-34-33-45-44-27-13-17-31-52(44)58-54(45)53(49)56(38-20-6-2-7-21-38)40-32-35-51-46(36-40)43-26-12-16-30-50(43)57(51)39-22-8-3-9-23-39/h1-36H
InChIKeyDNHOIICBIUPCLE-UHFFFAOYSA-N
XLogP14.52
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.91
LogP ≤ 514.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-3-yl-9-phenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]carbazol-3-amine
CID 129264393
N-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 164769090
N-[9-(4-dibenzofuran-4-ylphenyl)-9-(4-phenylphenyl)fluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 154955024
N-(9,9-diphenylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphtho[1,2-b][1]benzofuran-3-amine
CID 167277021
N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenylfluoren-3-amine;N-(4-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenylfluoren-3-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 158915505
N-(9,9-diphenylfluoren-3-yl)-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-3-amine
CID 129256023
N,9-diphenyl-N-(9,9'-spirobi[fluorene]-3-yl)carbazol-3-amine
CID 126538335
4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-[7-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-4-yl]phenyl]aniline
CID 164724630
N-(9,9-diphenylfluoren-2-yl)-N-[4-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 89426453
9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 129264403
4-(4-carbazol-9-ylphenyl)-N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N-phenylaniline
CID 164769104
N-dibenzofuran-4-yl-N-(11,11-diphenylbenzo[b]fluoren-2-yl)-9-phenylcarbazol-3-amine
CID 167036314

Frequently Asked Questions

What is the IUPAC name of N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine?
The IUPAC name of N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine (CID 158192922) is N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine.
What is the SMILES notation for N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine?
The canonical SMILES for N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine is c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c(C3(c4ccccc4)c4ccccc4-c4ccccc43)ccc3c2oc2ccccc23)cc1.
What is the InChIKey of N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine?
The InChIKey is DNHOIICBIUPCLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N2O/c1-4-18-37(19-5-1)55(47-28-14-10-24-41(47)42-25-11-15-29-48(42)55)49-34-33-45-44-27-13-17-31-52(44)58-54(45)53(49)56(38-20-6-2-7-21-38)40-32-35-51-46(36-40)43-26-12-16-30-50(43)57(51)39-22-8-3-9-23-39/h1-36H.
What are the key properties of N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine?
N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine has a molecular weight of 740.91 g/mol, XLogP of 14.52, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,9-diphenyl-N-[3-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]carbazol-3-amine is sourced from PubChem (CID 158192922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).