About (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine
(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine (PubChem CID 143610087) has the molecular formula C10H16N2
and a molecular weight of 164.25 g/mol. Its IUPAC name is (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine.
Molecular Properties
| Compound Name | (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine |
| PubChem CID | 143610087 |
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.25 g/mol |
| Exact Mass | 164.13 |
| IUPAC Name | (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine |
| SMILES | C=C1CCCN(C)/C1=C/C=N/C |
| InChI | InChI=1S/C10H16N2/c1-9-5-4-8-12(3)10(9)6-7-11-2/h6-7H,1,4-5,8H2,2-3H3/b10-6+,11-7+ |
| InChIKey | ZIWFGVZGBILSQA-JMQWPVDRSA-N |
| XLogP | 1.85 |
| TPSA | 15.60 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 164.25 |
| LogP ≤ 5 | 1.85 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
The IUPAC name of (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine (CID 143610087) is (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine.
What is the SMILES notation for (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
The canonical SMILES for (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine is C=C1CCCN(C)/C1=C/C=N/C.
What is the InChIKey of (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
The InChIKey is ZIWFGVZGBILSQA-JMQWPVDRSA-N. The full InChI is InChI=1S/C10H16N2/c1-9-5-4-8-12(3)10(9)6-7-11-2/h6-7H,1,4-5,8H2,2-3H3/b10-6+,11-7+.
What are the key properties of (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine?
(2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine has a molecular weight of 164.25 g/mol, XLogP of 1.85, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-methyl-2-(1-methyl-3-methylidenepiperidin-2-ylidene)ethanimine is sourced from PubChem (CID 143610087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).