2,5-Bis((dimethylamino)methyl)cyclopentanone hydrochloride
Basic information
- CAS
6333-22-8- Standard SMILES
CN(C)CC1CCC(CN(C)C)C1=O.Cl- InChIKey
ZVXGOLVRKYRGHM-UHFFFAOYSA-N- Molecular formula
- C11H23ClN2O
- Average molar mass
- 234.76 g/mol
- Monoisotopic mass
- 234.1498911
Names & identifiers
- Preferred name
- 2,5-Bis((dimethylamino)methyl)cyclopentanone hydrochloride
- IUPAC
- 2,5-bis[(dimethylamino)methyl]cyclopentan-1-one;hydrochloride
Names & synonyms
2,5-Bis((dimethylamino)methyl)cyclopentanone hydrochloride6333-22-8CHEMBL1981431DTXSID40327268NSC38522NSC-38522NSC131233NSC-131233Cyclopentanone,5-bis[(dimethylamino)methyl]-, dihydrochloride2,5-Bis[(dimethylamino)methyl]cyclopentan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
6333-22-8- PubChem CID
- 368963
- DTXSID
DTXSID40327268- ChEMBL
CHEMBL1981431
Properties
Computed structural properties
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 181
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Compound notes
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