N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine

C46H30N2O — CID 155398283

IUPACN-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine
SMILESc1cc(-c2cccc3oc4ccccc4c23)cc(N(c2cccc(-n3c4ccccc4c4ccccc43)c2)c2cccc3ccccc23)c1
InChIInChI=1S/C46H30N2O/c1-2-19-36-31(13-1)14-10-26-41(36)47(33-16-9-15-32(29-33)37-23-12-28-45-46(37)40-22-5-8-27-44(40)49-45)34-17-11-18-35(30-34)48-42-24-6-3-20-38(42)39-21-4-7-25-43(39)48/h1-30H
InChIKeyVRBYZZLUXPGLJE-UHFFFAOYSA-N
MW626.76 g/mol
LogP12.97
Rot. Bonds5

About N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine

N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine (PubChem CID 155398283) has the molecular formula C46H30N2O and a molecular weight of 626.76 g/mol. Its IUPAC name is N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine
PubChem CID155398283
Molecular FormulaC46H30N2O
Molecular Weight626.76 g/mol
Exact Mass626.24
IUPAC NameN-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine
SMILESc1cc(-c2cccc3oc4ccccc4c23)cc(N(c2cccc(-n3c4ccccc4c4ccccc43)c2)c2cccc3ccccc23)c1
InChIInChI=1S/C46H30N2O/c1-2-19-36-31(13-1)14-10-26-41(36)47(33-16-9-15-32(29-33)37-23-12-28-45-46(37)40-22-5-8-27-44(40)49-45)34-17-11-18-35(30-34)48-42-24-6-3-20-38(42)39-21-4-7-25-43(39)48/h1-30H
InChIKeyVRBYZZLUXPGLJE-UHFFFAOYSA-N
XLogP12.97
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500626.76
LogP ≤ 512.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-carbazol-9-ylphenyl)-N-(3-naphtho[1,2-b][1]benzofuran-7-ylphenyl)dibenzofuran-1-amine
CID 169283939
N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-2-amine
CID 155398285
N-(3-carbazol-9-ylphenyl)-2-dibenzofuran-1-yl-N-[3-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 167325919
N-(3-carbazol-9-ylphenyl)-2-dibenzofuran-1-yl-N-(3-phenanthren-2-ylphenyl)aniline
CID 155398314
N-(3-carbazol-9-ylphenyl)-3-dibenzofuran-1-yl-N-(4-phenanthren-2-ylphenyl)aniline
CID 155649180
N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-3-ylphenyl)-2-naphthalen-1-ylaniline
CID 153314589
3-carbazol-9-yl-N-[4-(3-dibenzofuran-1-ylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)aniline
CID 155398643
N-[4-(3-carbazol-9-ylphenyl)phenyl]-2-dibenzofuran-1-yl-N-[3-(4-phenylphenyl)phenyl]aniline
CID 155398509
N-(3-carbazol-9-ylphenyl)-N-[4-(3-dibenzofuran-3-ylphenyl)phenyl]naphthalen-1-amine
CID 148923282
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)-3-naphthalen-1-ylaniline
CID 155398157
3-carbazol-9-yl-N-(4-dibenzofuran-1-ylphenyl)-N-phenylaniline
CID 155397910
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(3-dibenzofuran-1-ylphenyl)phenyl]-3-phenylaniline
CID 155398563

Frequently Asked Questions

What is the IUPAC name of N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine?
The IUPAC name of N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine (CID 155398283) is N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine?
The canonical SMILES for N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine is c1cc(-c2cccc3oc4ccccc4c23)cc(N(c2cccc(-n3c4ccccc4c4ccccc43)c2)c2cccc3ccccc23)c1.
What is the InChIKey of N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine?
The InChIKey is VRBYZZLUXPGLJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2O/c1-2-19-36-31(13-1)14-10-26-41(36)47(33-16-9-15-32(29-33)37-23-12-28-45-46(37)40-22-5-8-27-44(40)49-45)34-17-11-18-35(30-34)48-42-24-6-3-20-38(42)39-21-4-7-25-43(39)48/h1-30H.
What are the key properties of N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine?
N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine has a molecular weight of 626.76 g/mol, XLogP of 12.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbazol-9-ylphenyl)-N-(3-dibenzofuran-1-ylphenyl)naphthalen-1-amine is sourced from PubChem (CID 155398283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).