About N,N'-ditert-butyl-N-methylethanimidamide
N,N'-ditert-butyl-N-methylethanimidamide (PubChem CID 174108678) has the molecular formula C11H24N2
and a molecular weight of 184.33 g/mol. Its IUPAC name is N,N'-ditert-butyl-N-methylethanimidamide.
Molecular Properties
| Compound Name | N,N'-ditert-butyl-N-methylethanimidamide |
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| PubChem CID | 174108678 |
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| Molecular Formula | C11H24N2 |
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| Molecular Weight | 184.33 g/mol |
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| Exact Mass | 184.19 |
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| IUPAC Name | N,N'-ditert-butyl-N-methylethanimidamide |
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| SMILES | C/C(=N\C(C)(C)C)N(C)C(C)(C)C |
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| InChI | InChI=1S/C11H24N2/c1-9(12-10(2,3)4)13(8)11(5,6)7/h1-8H3/b12-9+ |
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| InChIKey | CMSUONCZNYTXPN-FMIVXFBMSA-N |
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| XLogP | 2.93 |
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| TPSA | 15.60 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 1 |
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| Rotatable Bonds | |
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| Heavy Atoms | 13 |
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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 | 184.33 |
| LogP ≤ 5 | 2.93 |
| 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'} |
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Frequently Asked Questions
What is the IUPAC name of N,N'-ditert-butyl-N-methylethanimidamide?
The IUPAC name of N,N'-ditert-butyl-N-methylethanimidamide (CID 174108678) is N,N'-ditert-butyl-N-methylethanimidamide.
What is the SMILES notation for N,N'-ditert-butyl-N-methylethanimidamide?
The canonical SMILES for N,N'-ditert-butyl-N-methylethanimidamide is C/C(=N\C(C)(C)C)N(C)C(C)(C)C.
What is the InChIKey of N,N'-ditert-butyl-N-methylethanimidamide?
The InChIKey is CMSUONCZNYTXPN-FMIVXFBMSA-N. The full InChI is InChI=1S/C11H24N2/c1-9(12-10(2,3)4)13(8)11(5,6)7/h1-8H3/b12-9+.
What are the key properties of N,N'-ditert-butyl-N-methylethanimidamide?
N,N'-ditert-butyl-N-methylethanimidamide has a molecular weight of 184.33 g/mol, XLogP of 2.93, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-ditert-butyl-N-methylethanimidamide is sourced from PubChem (CID 174108678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).