Benzamide, 4-amino-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-2,3,5,6-tetramethyl-
Basic information
- CAS
104373-50-4- Standard SMILES
Cc1c(C)c(C(=O)NCCN2CCN(c3ccccn3)CC2)c(C)c(C)c1N- InChIKey
XCGBHKFYNWGXQJ-UHFFFAOYSA-N- Molecular formula
- C22H31N5O
- Average molar mass
- 381.5 g/mol
- Monoisotopic mass
- 381.25286063
Names & identifiers
- Preferred name
- Benzamide, 4-amino-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-2,3,5,6-tetramethyl-
- IUPAC
- 4-amino-2,3,5,6-tetramethyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzamide
Names & synonyms
BRN 5622279Benzamide, 4-amino-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-2,3,5,6-tetramethyl-104373-50-4DTXSID901464064-Amino-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-2,3,5,6-tetramethylbenzamideRefChem:321679DTXCID7068897CHEMBL556404-amino-2,3,5,6-tetramethyl-n-{2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide
Database identifiers
- CAS
104373-50-4- PubChem CID
- 59839
- DTXSID
DTXSID90146406- ChEMBL
CHEMBL55640
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 491
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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