About 4-(2-amino-9H-carbazol-4-yl)phenol
4-(2-amino-9H-carbazol-4-yl)phenol (PubChem CID 174518195) has the molecular formula C18H14N2O
and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-(2-amino-9H-carbazol-4-yl)phenol.
Molecular Properties
| Compound Name | 4-(2-amino-9H-carbazol-4-yl)phenol |
| PubChem CID | 174518195 |
| Molecular Formula | C18H14N2O |
| Molecular Weight | 274.32 g/mol |
| Exact Mass | 274.11 |
| IUPAC Name | 4-(2-amino-9H-carbazol-4-yl)phenol |
| SMILES | Nc1cc(-c2ccc(O)cc2)c2c(c1)[nH]c1ccccc12 |
| InChI | InChI=1S/C18H14N2O/c19-12-9-15(11-5-7-13(21)8-6-11)18-14-3-1-2-4-16(14)20-17(18)10-12/h1-10,20-21H,19H2 |
| InChIKey | JYWBBGYNIXVWPY-UHFFFAOYSA-N |
| XLogP | 4.28 |
| TPSA | 62.04 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 274.32 |
| LogP ≤ 5 | 4.28 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-amino-9H-carbazol-4-yl)phenol?
The IUPAC name of 4-(2-amino-9H-carbazol-4-yl)phenol (CID 174518195) is 4-(2-amino-9H-carbazol-4-yl)phenol.
What is the SMILES notation for 4-(2-amino-9H-carbazol-4-yl)phenol?
The canonical SMILES for 4-(2-amino-9H-carbazol-4-yl)phenol is Nc1cc(-c2ccc(O)cc2)c2c(c1)[nH]c1ccccc12.
What is the InChIKey of 4-(2-amino-9H-carbazol-4-yl)phenol?
The InChIKey is JYWBBGYNIXVWPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c19-12-9-15(11-5-7-13(21)8-6-11)18-14-3-1-2-4-16(14)20-17(18)10-12/h1-10,20-21H,19H2.
What are the key properties of 4-(2-amino-9H-carbazol-4-yl)phenol?
4-(2-amino-9H-carbazol-4-yl)phenol has a molecular weight of 274.32 g/mol, XLogP of 4.28, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-9H-carbazol-4-yl)phenol is sourced from PubChem (CID 174518195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).