About N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine
N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine (PubChem CID 6900607) has the molecular formula C10H16N4O
and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine.
Molecular Properties
| Compound Name | N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine |
| PubChem CID | 6900607 |
| Molecular Formula | C10H16N4O |
| Molecular Weight | 208.26 g/mol |
| Exact Mass | 208.13 |
| IUPAC Name | N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine |
| SMILES | CN(C)/N=C/c1ccc(/C=N/N(C)C)o1 |
| InChI | InChI=1S/C10H16N4O/c1-13(2)11-7-9-5-6-10(15-9)8-12-14(3)4/h5-8H,1-4H3/b11-7+,12-8+ |
| InChIKey | SMZNAHYTURPPKZ-MKICQXMISA-N |
| XLogP | 1.07 |
| TPSA | 44.34 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 208.26 |
| LogP ≤ 5 | 1.07 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine?
The IUPAC name of N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine (CID 6900607) is N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine.
What is the SMILES notation for N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine?
The canonical SMILES for N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine is CN(C)/N=C/c1ccc(/C=N/N(C)C)o1.
What is the InChIKey of N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine?
The InChIKey is SMZNAHYTURPPKZ-MKICQXMISA-N. The full InChI is InChI=1S/C10H16N4O/c1-13(2)11-7-9-5-6-10(15-9)8-12-14(3)4/h5-8H,1-4H3/b11-7+,12-8+.
What are the key properties of N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine?
N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine has a molecular weight of 208.26 g/mol, XLogP of 1.07, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[5-[(E)-(dimethylhydrazinylidene)methyl]furan-2-yl]methylideneamino]-N-methylmethanamine is sourced from PubChem (CID 6900607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).