Basic information
- CAS
65822-42-6- Standard SMILES
CCCCCC(C)(C)NC(=O)CN- InChIKey
XSXYHGVTOLLCAU-UHFFFAOYSA-N- Molecular formula
- C10H22N2O
- Average molar mass
- 186.29 g/mol
- Monoisotopic mass
- 186.17321332
Overview
structure given in first source
Names & identifiers
- Preferred name
- A 643C
- IUPAC
- 2-amino-N-(2-methylheptan-2-yl)acetamide
- English name
- A 643C
- Molecular formula
- C10H22N2O
- Molecular weight
- 186.29
Names & synonyms
65822-42-6A 643CA643CA-643CRefChem:1083142-amino-N-(2-methylheptan-2-yl)acetamideAcetamide, 2-amino-N-(1,1-dimethylhexyl)-2-Amino-N-(1,1-dimethylhexyl)acetamidestarbld0006400orb1701376SCHEMBL11336312DTXSID80984314
Show more names
XSXYHGVTOLLCAU-UHFFFAOYSA-NAKOS038056314HY-121751CS-0083154Amino-N-(2-methylheptan-2-yl)ethanimidic acidT264282-Amino-N-(2-methylheptan-2-yl)ethanimidic acid
Database identifiers
- CAS
65822-42-6- PubChem CID
- 128299
- DTXSID
DTXSID80984314
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Boiling point
- 320.8 · 320.8±25.0 °C(Predicted)
- Density
- 0.916 · 0.916±0.06 g/cm3(Predicted)
- pka
- 15.33 · 15.33±0.46(Predicted)
Chemistry & industry
Applications
DescriptionA 643C is an investigative antidepressant.
UsesA 643C is an investigative antidepressant[1].
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
13 records
Compound notes
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