1,1-Dimethylethyl 4-methyl-4-[(3-methyl-1-piperazinyl)carbonyl]-1-piperidinecarboxylate
Basic information
- CAS
885523-67-1- Standard SMILES
CC1CN(C(=O)C2(C)CCN(C(=O)OC(C)(C)C)CC2)CCN1- InChIKey
BEUSIDHGUUVJCZ-UHFFFAOYSA-N- Molecular formula
- C17H31N3O3
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.23654186
Names & identifiers
- Preferred name
- 1,1-Dimethylethyl 4-methyl-4-[(3-methyl-1-piperazinyl)carbonyl]-1-piperidinecarboxylate
- IUPAC
- tert-butyl 4-methyl-4-(3-methylpiperazine-1-carbonyl)piperidine-1-carboxylate
Names & synonyms
DTXSID6011252751,1-Dimethylethyl 4-methyl-4-[(3-methyl-1-piperazinyl)carbonyl]-1-piperidinecarboxylate885523-67-1tert-Butyl 4-methyl-4-(3-methylpiperazine-1-carbonyl)piperidine-1-carboxylate
Database identifiers
- CAS
885523-67-1- PubChem CID
- 53399285
- DTXSID
DTXSID601125275
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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