Basic information
- CAS
20846-41-7- Standard SMILES
Cc1cccc(C)c1NC(=O)CNCC(C)O.Cl- InChIKey
WMVJMDXGDANYMB-UHFFFAOYSA-N- Molecular formula
- C13H21ClN2O2
- Average molar mass
- 272.77 g/mol
- Monoisotopic mass
- 272.1291556
Overview
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Names & identifiers
- Preferred name
- N-(2,6-Dimethylphenyl)[(2-hydroxypropyl)amino]ethanimidic acid--hydrogen chloride (1/1)
- IUPAC
- N-(2,6-dimethylphenyl)-2-(2-hydroxypropylamino)acetamide;hydrochloride
Names & synonyms
DTXSID10943095N-(2,6-Dimethylphenyl)-2-[(2-hydroxypropyl)amino]ethanimidato--hydrogen chlorido (1/1)N-(2,6-Dimethylphenyl)[(2-hydroxypropyl)amino]ethanimidic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
20846-41-7- PubChem CID
- 92017151
- DTXSID
DTXSID10943095
Properties
Computed structural properties
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
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Compound notes
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