Basic information
- Standard SMILES
CC(C)N1CCN(C(=O)c2ccc(CN3CCCCC3)nc2)CC1- InChIKey
HGMKONUWLRPGDN-UHFFFAOYSA-N- Molecular formula
- C19H30N4O
- Average molar mass
- 330.5 g/mol
Names & identifiers
- Preferred name
- (4-Isopropyl-piperazin-1-yl)-(6-piperidin-1-ylmethyl-pyridin-3-yl)-methanone
- IUPAC
- [6-(piperidin-1-ylmethyl)-3-pyridinyl]-(4-propan-2-ylpiperazin-1-yl)methanone
Names & synonyms
CHEMBL1783893SCHEMBL1856859HGMKONUWLRPGDN-UHFFFAOYSA-NBDBM50346201(4-Isopropyl-piperazin-1-yl)-(6-piperidin-1-ylmethyl-pyridin-3-yl)-methanone(4-Isopropyl-piperazin-1-yl)-(6-piperidin-1-ylmethylpyridin-3-yl)-methanone
Database identifiers
- PubChem CID
- 11522780
- ChEMBL
CHEMBL1783893
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 400
Related reactions
5 records
Linked notes
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