Basic information
- CAS
101651-66-5- Standard SMILES
C[NH+](CC[NH+]1CCCCC1)CC(=O)Nc1ccccc1Cl.[Cl-].[Cl-]- InChIKey
VDRBPOQUXKJSTF-UHFFFAOYSA-N- Molecular formula
- C16H26Cl3N3O
- Average molar mass
- 382.8 g/mol
- Monoisotopic mass
- 381.114146
Names & identifiers
- Preferred name
- Acetanilide, o-chloro-2-(methyl(2-(piperidino)ethyl)amino)-, dihydrochloride
- IUPAC
- [2-(2-chloroanilino)-2-oxoethyl]-methyl-(2-piperidin-1-ium-1-ylethyl)azanium dichloride
Names & synonyms
101651-66-5ACETANILIDE, o-CHLORO-2-(METHYL(2-(PIPERIDINO)ETHYL)AMINO)-, DIHYDROCHLORIDERefChem:1075487o-Chloro-2-(methyl(2-(piperidino)ethyl)amino)acetanilide dihydrochlorideC 5406[2-(2-chloroanilino)-2-oxoethyl]-methyl-(2-piperidin-1-ium-1-ylethyl)azanium;dichloride(2-chlorophenyl)carbamoylmethyl-methyl-[2-(3,4,5,6-tetrahydro-2H-pyrid in-1-yl)ethyl]azanium dichlor
Database identifiers
- CAS
101651-66-5- PubChem CID
- 58626
Properties
Computed structural properties
- Topological polar surface area
- 38 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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