About 4-butyl-N-ethyl-N-methylpyridin-2-amine
4-butyl-N-ethyl-N-methylpyridin-2-amine (PubChem CID 142596545) has the molecular formula C12H20N2
and a molecular weight of 192.31 g/mol. Its IUPAC name is 4-butyl-N-ethyl-N-methylpyridin-2-amine.
Molecular Properties
| Compound Name | 4-butyl-N-ethyl-N-methylpyridin-2-amine |
| PubChem CID | 142596545 |
| Molecular Formula | C12H20N2 |
| Molecular Weight | 192.31 g/mol |
| Exact Mass | 192.16 |
| IUPAC Name | 4-butyl-N-ethyl-N-methylpyridin-2-amine |
| SMILES | CCCCc1ccnc(N(C)CC)c1 |
| InChI | InChI=1S/C12H20N2/c1-4-6-7-11-8-9-13-12(10-11)14(3)5-2/h8-10H,4-7H2,1-3H3 |
| InChIKey | FTXRTONPPLICEQ-UHFFFAOYSA-N |
| XLogP | 2.88 |
| TPSA | 16.13 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 192.31 |
| LogP ≤ 5 | 2.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-butyl-N-ethyl-N-methylpyridin-2-amine?
The IUPAC name of 4-butyl-N-ethyl-N-methylpyridin-2-amine (CID 142596545) is 4-butyl-N-ethyl-N-methylpyridin-2-amine.
What is the SMILES notation for 4-butyl-N-ethyl-N-methylpyridin-2-amine?
The canonical SMILES for 4-butyl-N-ethyl-N-methylpyridin-2-amine is CCCCc1ccnc(N(C)CC)c1.
What is the InChIKey of 4-butyl-N-ethyl-N-methylpyridin-2-amine?
The InChIKey is FTXRTONPPLICEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-6-7-11-8-9-13-12(10-11)14(3)5-2/h8-10H,4-7H2,1-3H3.
What are the key properties of 4-butyl-N-ethyl-N-methylpyridin-2-amine?
4-butyl-N-ethyl-N-methylpyridin-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-ethyl-N-methylpyridin-2-amine is sourced from PubChem (CID 142596545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).