About N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine
N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine (PubChem CID 144888442) has the molecular formula C34H23BrN2
and a molecular weight of 539.48 g/mol. Its IUPAC name is N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine.
Molecular Properties
| Compound Name | N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine |
| PubChem CID | 144888442 |
| Molecular Formula | C34H23BrN2 |
| Molecular Weight | 539.48 g/mol |
| Exact Mass | 538.10 |
| IUPAC Name | N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine |
| SMILES | Brc1cc(N(c2ccccc2)c2ccc3ccccc3c2)cc(-n2c3ccccc3c3ccccc32)c1 |
| InChI | InChI=1S/C34H23BrN2/c35-26-21-29(23-30(22-26)37-33-16-8-6-14-31(33)32-15-7-9-17-34(32)37)36(27-12-2-1-3-13-27)28-19-18-24-10-4-5-11-25(24)20-28/h1-23H |
| InChIKey | KMJQGIYKIPQAQF-UHFFFAOYSA-N |
| XLogP | 10.17 |
| TPSA | 8.17 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 37 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 539.48 |
| LogP ≤ 5 | 10.17 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine?
The IUPAC name of N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine (CID 144888442) is N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine.
What is the SMILES notation for N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine?
The canonical SMILES for N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine is Brc1cc(N(c2ccccc2)c2ccc3ccccc3c2)cc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine?
The InChIKey is KMJQGIYKIPQAQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23BrN2/c35-26-21-29(23-30(22-26)37-33-16-8-6-14-31(33)32-15-7-9-17-34(32)37)36(27-12-2-1-3-13-27)28-19-18-24-10-4-5-11-25(24)20-28/h1-23H.
What are the key properties of N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine?
N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine has a molecular weight of 539.48 g/mol, XLogP of 10.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine is sourced from PubChem (CID 144888442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).