[1-[(Dimethylamino)methyl]cyclopentyl]methyl 4-aminobenzoate
Basic information
- CAS
39943-33-4- Standard SMILES
CN(C)CC1(COC(=O)c2ccc(N)cc2)CCCC1- InChIKey
TUJSUONDGOTZRD-UHFFFAOYSA-N- Molecular formula
- C16H24N2O2
- Average molar mass
- 276.37 g/mol
- Monoisotopic mass
- 276.18377801
Names & identifiers
- Preferred name
- [1-[(Dimethylamino)methyl]cyclopentyl]methyl 4-aminobenzoate
- IUPAC
- [1-[(dimethylamino)methyl]cyclopentyl]methyl 4-aminobenzoate
Names & synonyms
NSC17163639943-33-4DTXSID80305767NSC-171636{1-[(DIMETHYLAMINO)METHYL]CYCLOPENTYL}METHYL 4-AMINOBENZOATE
Database identifiers
- CAS
39943-33-4- PubChem CID
- 299168
- DTXSID
DTXSID80305767
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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