About N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide
N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide (PubChem CID 142396743) has the molecular formula C10H16N2
and a molecular weight of 164.25 g/mol. Its IUPAC name is N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide.
Molecular Properties
| Compound Name | N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide |
| PubChem CID | 142396743 |
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.25 g/mol |
| Exact Mass | 164.13 |
| IUPAC Name | N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide |
| SMILES | C/C=C\N=C(C)\N=C\C(C)=C/C |
| InChI | InChI=1S/C10H16N2/c1-5-7-11-10(4)12-8-9(3)6-2/h5-8H,1-4H3/b7-5-,9-6-,11-10+,12-8+ |
| InChIKey | OLLRLIPRXMYJFL-SCTGIQMDSA-N |
| XLogP | 2.98 |
| TPSA | 24.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 164.25 |
| LogP ≤ 5 | 2.98 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'} |
|---|
Analyze N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
The IUPAC name of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide (CID 142396743) is N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide.
What is the SMILES notation for N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
The canonical SMILES for N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide is C/C=C\N=C(C)\N=C\C(C)=C/C.
What is the InChIKey of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
The InChIKey is OLLRLIPRXMYJFL-SCTGIQMDSA-N. The full InChI is InChI=1S/C10H16N2/c1-5-7-11-10(4)12-8-9(3)6-2/h5-8H,1-4H3/b7-5-,9-6-,11-10+,12-8+.
What are the key properties of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide has a molecular weight of 164.25 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide is sourced from PubChem (CID 142396743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).