| CAS Number | 1803586-06-2 |
| Catalog Number | AG01B8ZD |
| Chemical Name | N-(2-{[(5-methylthiophen-2-yl)methyl]amino}ethyl)acetamide hydrochloride |
| IUPAC Name | N-[2-[(5-methylthiophen-2-yl)methylamino]ethyl]acetamide;hydrochloride |
| InChI | InChI=1S/C10H16N2OS.ClH/c1-8-3-4-10(14-8)7-11-5-6-12-9(2)13;/h3-4,11H,5-7H2,1-2H3,(H,12,13);1H |
| InChI Key | ROUAUYCRBWZACL-UHFFFAOYSA-N |
| MDL Number | MFCD28348183 |
| Molecular Formula | C10H17ClN2OS |
| Molecular Weight | 248.7728 |
| SMILES | Cl.CC(NCCNCC1SC(C)=CC=1)=O |
| Synonyms | N-(2-{[(5-methylthiophen-2-yl)methyl]amino}ethyl)acetamide hydrochloride,
1803586-06-2,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.769g/mol |
| Monoisotopic Mass | 248.075g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 69.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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