N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine

C48H32N2O — CID 166134940

IUPACN-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2N(c2c(-c3ccccc3)cccc2-c2cccc3c2[nH]c2ccccc23)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/C48H32N2O/c1-3-16-32(17-4-1)34-20-8-11-28-42(34)50(43-29-15-31-45-46(43)40-22-9-12-30-44(40)51-45)48-35(33-18-5-2-6-19-33)23-13-26-39(48)38-25-14-24-37-36-21-7-10-27-41(36)49-47(37)38/h1-31,49H
InChIKeyAQLRDLPNEGFJGG-UHFFFAOYSA-N
MW652.80 g/mol
LogP13.69
Rot. Bonds6

About N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine

N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine (PubChem CID 166134940) has the molecular formula C48H32N2O and a molecular weight of 652.80 g/mol. Its IUPAC name is N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine.

Molecular Properties

Compound NameN-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
PubChem CID166134940
Molecular FormulaC48H32N2O
Molecular Weight652.80 g/mol
Exact Mass652.25
IUPAC NameN-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2N(c2c(-c3ccccc3)cccc2-c2cccc3c2[nH]c2ccccc23)c2cccc3oc4ccccc4c23)cc1
InChIInChI=1S/C48H32N2O/c1-3-16-32(17-4-1)34-20-8-11-28-42(34)50(43-29-15-31-45-46(43)40-22-9-12-30-44(40)51-45)48-35(33-18-5-2-6-19-33)23-13-26-39(48)38-25-14-24-37-36-21-7-10-27-41(36)49-47(37)38/h1-31,49H
InChIKeyAQLRDLPNEGFJGG-UHFFFAOYSA-N
XLogP13.69
TPSA32.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500652.80
LogP ≤ 513.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(9H-carbazol-1-yl)-N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N,6-diphenylaniline
CID 166135032
2-(9H-carbazol-1-yl)-N,N-bis[2-(9H-carbazol-1-yl)phenyl]aniline
CID 68812374
N-[2-(4-phenylphenyl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 168790854
N-(2-dibenzofuran-1-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 155186765
N-(4-dibenzofuran-1-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 155186868
N-(2-dibenzofuran-1-ylphenyl)-N-phenyldibenzofuran-1-amine;N-(2-dibenzofuran-1-ylphenyl)-N-(2-phenylphenyl)dibenzofuran-1-amine;N-(2-dibenzofuran-1-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine;N-(2-dibenzofuran-1-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(2-dibenzofuran-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 158387257
2-N,6-N-di(dibenzofuran-1-yl)-3,7-diphenyl-2-N,6-N-bis(2-phenylphenyl)naphthalene-2,6-diamine
CID 158255217
N-(4-dibenzofuran-1-ylphenyl)-N-[2-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 155186946
2-(4-naphthalen-1-ylphenyl)-N,N-bis(2-phenylphenyl)dibenzofuran-1-amine
CID 174262192
N-[4-(3-phenylnaphthalen-2-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 154605463
1-[2-[4,6-di(dibenzofuran-1-yl)triazin-5-yl]-3-phenylphenyl]-9H-carbazole
CID 166134015
N-[4-(3-phenylphenyl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 172502312

Frequently Asked Questions

What is the IUPAC name of N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
The IUPAC name of N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine (CID 166134940) is N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine.
What is the SMILES notation for N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
The canonical SMILES for N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine is c1ccc(-c2ccccc2N(c2c(-c3ccccc3)cccc2-c2cccc3c2[nH]c2ccccc23)c2cccc3oc4ccccc4c23)cc1.
What is the InChIKey of N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
The InChIKey is AQLRDLPNEGFJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2O/c1-3-16-32(17-4-1)34-20-8-11-28-42(34)50(43-29-15-31-45-46(43)40-22-9-12-30-44(40)51-45)48-35(33-18-5-2-6-19-33)23-13-26-39(48)38-25-14-24-37-36-21-7-10-27-41(36)49-47(37)38/h1-31,49H.
What are the key properties of N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine?
N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine has a molecular weight of 652.80 g/mol, XLogP of 13.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine is sourced from PubChem (CID 166134940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).