Basic information
- Standard SMILES
CCO[C@H](C)C[C@H](N)C(=O)Nc1ccn(CC(C)(C)O)n1.Cl- InChIKey
PORBFQJNDPSXBR-DHXVBOOMSA-N- Molecular formula
- C14H27ClN4O3
- Average molar mass
- 334.84 g/mol
Names & identifiers
- Preferred name
- (2S,4R)-2-amino-4-ethoxy-pentanoic acid [1-(2-hydroxy-2-methyl-propyl)-1H-pyrazol-3-yl]-amide hydrochloride
- IUPAC
- (2S,4R)-2-amino-4-ethoxy-N-[1-(2-hydroxy-2-methylpropyl)pyrazol-3-yl]pentanamide;hydrochloride
Names & synonyms
SCHEMBL1078301PORBFQJNDPSXBR-DHXVBOOMSA-N(2S,4R)-2-amino-4-ethoxy-pentanoic acid [1-(2-hydroxy-2-methyl-propyl)-1H-pyrazol-3-yl]-amide hydrochloride
Database identifiers
- PubChem CID
- 66898549
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 338
Related reactions
2 records
Compound notes
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