About N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine
N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine (PubChem CID 133292178) has the molecular formula C14H15BrN2
and a molecular weight of 291.19 g/mol. Its IUPAC name is N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine.
Molecular Properties
| Compound Name | N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine |
| PubChem CID | 133292178 |
| Molecular Formula | C14H15BrN2 |
| Molecular Weight | 291.19 g/mol |
| Exact Mass | 290.04 |
| IUPAC Name | N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine |
| SMILES | CN(CCc1ccc(Br)cc1)c1ccccn1 |
| InChI | InChI=1S/C14H15BrN2/c1-17(14-4-2-3-10-16-14)11-9-12-5-7-13(15)8-6-12/h2-8,10H,9,11H2,1H3 |
| InChIKey | LDRHPJSPTLBPFP-UHFFFAOYSA-N |
| XLogP | 3.52 |
| TPSA | 16.13 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.19 |
| LogP ≤ 5 | 3.52 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine?
The IUPAC name of N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine (CID 133292178) is N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine?
The canonical SMILES for N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine is CN(CCc1ccc(Br)cc1)c1ccccn1.
What is the InChIKey of N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine?
The InChIKey is LDRHPJSPTLBPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-17(14-4-2-3-10-16-14)11-9-12-5-7-13(15)8-6-12/h2-8,10H,9,11H2,1H3.
What are the key properties of N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine?
N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine has a molecular weight of 291.19 g/mol, XLogP of 3.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 133292178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).