2-tert-Butyl-2-[hydroxy(2-{hydroxy[(propan-2-yl)imino]methyl}-2-methylhydrazinylidene)methyl]pyrrolidine-1-carboxylic acid
Basic information
- CAS
139424-38-7- Standard SMILES
CC(C)NC(=O)N(C)NC(=O)[C@]1(C(C)(C)C)CCCN1C(=O)O- InChIKey
KKHKJCNBVQWGKU-HNNXBMFYSA-N- Molecular formula
- C15H28N4O4
- Average molar mass
- 328.41 g/mol
- Monoisotopic mass
- 328.21105539
Names & identifiers
- Preferred name
- 2-tert-Butyl-2-[hydroxy(2-{hydroxy[(propan-2-yl)imino]methyl}-2-methylhydrazinylidene)methyl]pyrrolidine-1-carboxylic acid
- IUPAC
- (2R)-2-tert-butyl-2-[[methyl(propan-2-ylcarbamoyl)amino]carbamoyl]pyrrolidine-1-carboxylic acid
- English name
- tert-butylcarboxy-prolyl-N-isopropylazaalaninamide
- Molecular formula
- C15H28N4O3
- Molecular weight
- 312.41
Names & synonyms
DTXSID90930468(2R)-2-tert-Butyl-2-[hydroxy(2-{hydroxy[(propan-2-yl)imino]methyl}-2-methylhydrazinylidene)methyl]pyrrolidine-1-carboxylic acid2-tert-Butyl-2-[hydroxy(2-{hydroxy[(propan-2-yl)imino]methyl}-2-methylhydrazinylidene)methyl]pyrrolidine-1-carboxylic acidtert-butylcarboxy-prolyl-N-isopropylazaalaninamideL-Proline, 1-(2,2-dimethyl-1-oxopropyl)-, 2-methyl-2-[[(1-methylethyl)amino]carbonyl]hydrazide
Database identifiers
- CAS
139424-38-7- PubChem CID
- 57348247
- DTXSID
DTXSID90930468
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 486
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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