Basic information
- Standard SMILES
CC(C)N1CCN(C(=O)c2ccc(NCCN3CCCCC3)nc2)CC1- InChIKey
AOHGNUVYWCFCAB-UHFFFAOYSA-N- Molecular formula
- C20H33N5O
- Average molar mass
- 359.5 g/mol
Names & identifiers
- Preferred name
- (4-Isopropyl-piperazin-1-yl)-[6-(2-piperidin-1-yl-ethylamino)-pyridin-3-yl]-methanone
- IUPAC
- [6-(2-piperidin-1-ylethylamino)-3-pyridinyl]-(4-propan-2-ylpiperazin-1-yl)methanone
Names & synonyms
SCHEMBL1863563AOHGNUVYWCFCAB-UHFFFAOYSA-N(4-Isopropyl-piperazin-1-yl)-[6-(2-piperidin-1-yl-ethylamino)-pyridin-3-yl]-methanone
Database identifiers
- PubChem CID
- 11710212
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 51.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 430
Related reactions
3 records
Linked notes
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