About N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide
N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide (PubChem CID 158534614) has the molecular formula C25H56N6O7S
and a molecular weight of 584.83 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide.
Molecular Properties
| Compound Name | N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide |
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| PubChem CID | 158534614 |
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| Molecular Formula | C25H56N6O7S |
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| Molecular Weight | 584.83 g/mol |
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| Exact Mass | 584.39 |
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| IUPAC Name | N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide |
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| SMILES | CC(=O)N(C)CCN(C)C.CC(=O)N(C)CCS(C)(=O)=O.CNCCN(C)C(C)=O.COCCN(C)C(C)=O |
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| InChI | InChI=1S/C7H16N2O.C6H14N2O.C6H13NO3S.C6H13NO2/c1-7(10)9(4)6-5-8(2)3;1-6(9)8(3)5-4-7-2;1-6(8)7(2)4-5-11(3,9)10;1-6(8)7(2)4-5-9-3/h5-6H2,1-4H3;7H,4-5H2,1-3H3;4-5H2,1-3H3;4-5H2,1-3H3 |
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| InChIKey | HNUCJYWCATYSFW-UHFFFAOYSA-N |
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| XLogP | -0.67 |
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| TPSA | 139.88 Ų |
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| H-Bond Donors | 1 |
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| H-Bond Acceptors | 9 |
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| Rotatable Bonds | 12 |
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| Heavy Atoms | 39 |
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| Complexity | — |
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Lipinski Rule of Five
1 violation
| Rule | Value |
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| MW ≤ 500 | 584.83 |
| LogP ≤ 5 | -0.67 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 9 |
Analyze N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide with MolForge
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Frequently Asked Questions
What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide (CID 158534614) is N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide is CC(=O)N(C)CCN(C)C.CC(=O)N(C)CCS(C)(=O)=O.CNCCN(C)C(C)=O.COCCN(C)C(C)=O.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide?
The InChIKey is HNUCJYWCATYSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O.C6H14N2O.C6H13NO3S.C6H13NO2/c1-7(10)9(4)6-5-8(2)3;1-6(9)8(3)5-4-7-2;1-6(8)7(2)4-5-11(3,9)10;1-6(8)7(2)4-5-9-3/h5-6H2,1-4H3;7H,4-5H2,1-3H3;4-5H2,1-3H3;4-5H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide?
N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide has a molecular weight of 584.83 g/mol, XLogP of -0.67, 12 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide is sourced from PubChem (CID 158534614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).