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Acetamide, N-(2,6-dimethylphenyl)-2-(methylpentylamino)-, monohydrochloride

HCID 37304
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Basic information

CAS
35891-89-5
Standard SMILES
CCCCC[NH+](C)CC(=O)Nc1c(C)cccc1C.[Cl-]
InChIKey
VGCMDANERVGBAR-UHFFFAOYSA-N
Molecular formula
C16H27ClN2O
Average molar mass
298.8 g/mol
Monoisotopic mass
298.1811912

Names & identifiers

Preferred name
Acetamide, N-(2,6-dimethylphenyl)-2-(methylpentylamino)-, monohydrochloride
IUPAC
[2-(2,6-dimethylanilino)-2-oxoethyl]-methyl-pentylazanium chloride

Names & synonyms

35891-89-5Acetamide, N-(2,6-dimethylphenyl)-2-(methylpentylamino)-, monohydrochlorideRefChem:10753212-(Methylpentylamino)-2',6'-acetoxylidide hydrochloride2',6'-ACETOXYLIDIDE, 2-(METHYLPENTYLAMINO)-, MONOHYDROCHLORIDE

Database identifiers

CAS
35891-89-5
PubChem CID
37304

Properties

Computed structural properties

Topological polar surface area
33.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
257

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