About 5-methoxy-N-phenyl-1H-indole-2-carboxamide
5-methoxy-N-phenyl-1H-indole-2-carboxamide (PubChem CID 10801701) has the molecular formula C16H14N2O2
and a molecular weight of 266.30 g/mol. Its IUPAC name is 5-methoxy-N-phenyl-1H-indole-2-carboxamide.
Molecular Properties
| Compound Name | 5-methoxy-N-phenyl-1H-indole-2-carboxamide |
| PubChem CID | 10801701 |
| Molecular Formula | C16H14N2O2 |
| Molecular Weight | 266.30 g/mol |
| Exact Mass | 266.11 |
| IUPAC Name | 5-methoxy-N-phenyl-1H-indole-2-carboxamide |
| SMILES | COc1ccc2[nH]c(C(=O)Nc3ccccc3)cc2c1 |
| InChI | InChI=1S/C16H14N2O2/c1-20-13-7-8-14-11(9-13)10-15(18-14)16(19)17-12-5-3-2-4-6-12/h2-10,18H,1H3,(H,17,19) |
| InChIKey | BUEDHKKMAVFPKO-UHFFFAOYSA-N |
| XLogP | 3.43 |
| TPSA | 54.12 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.30 |
| LogP ≤ 5 | 3.43 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-methoxy-N-phenyl-1H-indole-2-carboxamide?
The IUPAC name of 5-methoxy-N-phenyl-1H-indole-2-carboxamide (CID 10801701) is 5-methoxy-N-phenyl-1H-indole-2-carboxamide.
What is the SMILES notation for 5-methoxy-N-phenyl-1H-indole-2-carboxamide?
The canonical SMILES for 5-methoxy-N-phenyl-1H-indole-2-carboxamide is COc1ccc2[nH]c(C(=O)Nc3ccccc3)cc2c1.
What is the InChIKey of 5-methoxy-N-phenyl-1H-indole-2-carboxamide?
The InChIKey is BUEDHKKMAVFPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-20-13-7-8-14-11(9-13)10-15(18-14)16(19)17-12-5-3-2-4-6-12/h2-10,18H,1H3,(H,17,19).
What are the key properties of 5-methoxy-N-phenyl-1H-indole-2-carboxamide?
5-methoxy-N-phenyl-1H-indole-2-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 3.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-phenyl-1H-indole-2-carboxamide is sourced from PubChem (CID 10801701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).