Basic information
- Standard SMILES
COC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1- InChIKey
HXWOPDVINWBUOH-UHFFFAOYSA-N- Molecular formula
- C15H22N2O2
- Average molar mass
- 262.35 g/mol
Names & identifiers
- Preferred name
- Methyl 4-(4-propan-2-yl-piperazin-1-yl)benzoate
- IUPAC
- methyl 4-(4-propan-2-ylpiperazin-1-yl)benzoate
Names & synonyms
4-(4-Isopropyl-piperazin-1-yl)-benzoic acid methyl ester4-[4-Isopropyl-piperazin-1-yl]-benzoic acid methyl estermethyl 4-(4-propan-2-yl-piperazin-1-yl)benzoate354813-23-3SCHEMBL4652046HXWOPDVINWBUOH-UHFFFAOYSA-NDB-343341methyl 4-(4-propan-2-yl-piperizin-1-yl)benzoate
Database identifiers
- PubChem CID
- 69129778
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 291
Related reactions
10 records
Linked notes
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