About N'-(methylamino)-N-methylidenemethanimidamide
N'-(methylamino)-N-methylidenemethanimidamide (PubChem CID 142928984) has the molecular formula C3H7N3
and a molecular weight of 85.11 g/mol. Its IUPAC name is N'-(methylamino)-N-methylidenemethanimidamide.
Molecular Properties
| Compound Name | N'-(methylamino)-N-methylidenemethanimidamide |
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| PubChem CID | 142928984 |
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| Molecular Formula | C3H7N3 |
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| Molecular Weight | 85.11 g/mol |
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| Exact Mass | 85.06 |
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| IUPAC Name | N'-(methylamino)-N-methylidenemethanimidamide |
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| SMILES | C=N/C=N\NC |
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| InChI | InChI=1S/C3H7N3/c1-4-3-6-5-2/h3,5H,1H2,2H3/b6-3- |
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| InChIKey | DJAONPXACFREOB-UTCJRWHESA-N |
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| XLogP | -0.15 |
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| TPSA | 36.75 Ų |
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| H-Bond Donors | 1 |
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| H-Bond Acceptors | 2 |
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| Rotatable Bonds | 2 |
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| Heavy Atoms | 6 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
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| MW ≤ 500 | 85.11 |
| LogP ≤ 5 | -0.15 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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'-(methylamino)-N-methylidenemethanimidamide?
The IUPAC name of N'-(methylamino)-N-methylidenemethanimidamide (CID 142928984) is N'-(methylamino)-N-methylidenemethanimidamide.
What is the SMILES notation for N'-(methylamino)-N-methylidenemethanimidamide?
The canonical SMILES for N'-(methylamino)-N-methylidenemethanimidamide is C=N/C=N\NC.
What is the InChIKey of N'-(methylamino)-N-methylidenemethanimidamide?
The InChIKey is DJAONPXACFREOB-UTCJRWHESA-N. The full InChI is InChI=1S/C3H7N3/c1-4-3-6-5-2/h3,5H,1H2,2H3/b6-3-.
What are the key properties of N'-(methylamino)-N-methylidenemethanimidamide?
N'-(methylamino)-N-methylidenemethanimidamide has a molecular weight of 85.11 g/mol, XLogP of -0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(methylamino)-N-methylidenemethanimidamide is sourced from PubChem (CID 142928984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).