9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine

C48H30N2O2 — CID 118333364

IUPAC9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3c2)cc1
InChIInChI=1S/C48H30N2O2/c1-2-10-33(11-3-1)49(34-21-18-31(19-22-34)32-20-26-47-41(28-32)39-13-5-8-16-45(39)51-47)36-23-25-38-37-12-4-7-15-43(37)50(44(38)30-36)35-24-27-48-42(29-35)40-14-6-9-17-46(40)52-48/h1-30H
InChIKeyYOHQHYHTDGFBMY-UHFFFAOYSA-N
MW666.78 g/mol
LogP13.72
Rot. Bonds5

About 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine

9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine (PubChem CID 118333364) has the molecular formula C48H30N2O2 and a molecular weight of 666.78 g/mol. Its IUPAC name is 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine.

Molecular Properties

Compound Name9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine
PubChem CID118333364
Molecular FormulaC48H30N2O2
Molecular Weight666.78 g/mol
Exact Mass666.23
IUPAC Name9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3c2)cc1
InChIInChI=1S/C48H30N2O2/c1-2-10-33(11-3-1)49(34-21-18-31(19-22-34)32-20-26-47-41(28-32)39-13-5-8-16-45(39)51-47)36-23-25-38-37-12-4-7-15-43(37)50(44(38)30-36)35-24-27-48-42(29-35)40-14-6-9-17-46(40)52-48/h1-30H
InChIKeyYOHQHYHTDGFBMY-UHFFFAOYSA-N
XLogP13.72
TPSA34.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500666.78
LogP ≤ 513.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-dibenzofuran-2-yl-N-phenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 118333380
9-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylcarbazol-2-amine
CID 118333340
N-[4-(9-dibenzofuran-2-ylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)triphenylen-2-amine
CID 90321281
N-(4-carbazol-9-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-4-(4-phenylphenyl)aniline
CID 146578329
4-[4-(4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)anilino)phenyl]-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline
CID 58510759
3-[3-[3-dibenzofuran-2-yl-5-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]-N,N-bis(4-phenylphenyl)aniline;N-[3-[3-[3-dibenzofuran-2-yl-5-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]phenyl]-N,3-diphenylaniline
CID 161194033
5-dibenzofuran-2-yl-1-N,3-N-diphenyl-1-N,3-N-bis(9-phenylcarbazol-2-yl)benzene-1,3-diamine
CID 122634225
N-[4-[4-[3-(4-dibenzofuran-2-ylphenyl)carbazol-9-yl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118402378
N-phenyl-N-[4-[3-(9-phenylcarbazol-2-yl)-5-(9-phenylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-2-amine
CID 118289224
3-dibenzofuran-2-yl-N,N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]aniline
CID 121443776
3-dibenzofuran-2-yl-N,N-diphenyl-5-[9-(4-phenylphenyl)carbazol-2-yl]aniline
CID 121443777
N-[3-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 121260620

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine?
The IUPAC name of 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine (CID 118333364) is 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine.
What is the SMILES notation for 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine?
The canonical SMILES for 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine is c1ccc(N(c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)c2ccc3c4ccccc4n(-c4ccc5oc6ccccc6c5c4)c3c2)cc1.
What is the InChIKey of 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine?
The InChIKey is YOHQHYHTDGFBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O2/c1-2-10-33(11-3-1)49(34-21-18-31(19-22-34)32-20-26-47-41(28-32)39-13-5-8-16-45(39)51-47)36-23-25-38-37-12-4-7-15-43(37)50(44(38)30-36)35-24-27-48-42(29-35)40-14-6-9-17-46(40)52-48/h1-30H.
What are the key properties of 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine?
9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine has a molecular weight of 666.78 g/mol, XLogP of 13.72, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-phenylcarbazol-2-amine is sourced from PubChem (CID 118333364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).