About 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine
1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine (PubChem CID 64775844) has the molecular formula C14H23N3
and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine.
Molecular Properties
| Compound Name | 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine |
| PubChem CID | 64775844 |
| Molecular Formula | C14H23N3 |
| Molecular Weight | 233.36 g/mol |
| Exact Mass | 233.19 |
| IUPAC Name | 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine |
| SMILES | CCC1CCC(C(NC)c2cnccn2)CC1 |
| InChI | InChI=1S/C14H23N3/c1-3-11-4-6-12(7-5-11)14(15-2)13-10-16-8-9-17-13/h8-12,14-15H,3-7H2,1-2H3 |
| InChIKey | ABRRXPLDAASLQM-UHFFFAOYSA-N |
| XLogP | 2.95 |
| TPSA | 37.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.36 |
| LogP ≤ 5 | 2.95 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine?
The IUPAC name of 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine (CID 64775844) is 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine.
What is the SMILES notation for 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine?
The canonical SMILES for 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine is CCC1CCC(C(NC)c2cnccn2)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine?
The InChIKey is ABRRXPLDAASLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-11-4-6-12(7-5-11)14(15-2)13-10-16-8-9-17-13/h8-12,14-15H,3-7H2,1-2H3.
What are the key properties of 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine?
1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine is sourced from PubChem (CID 64775844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).