About amino (2R)-5-amino-2-formamidopentanoate
amino (2R)-5-amino-2-formamidopentanoate (PubChem CID 174668707) has the molecular formula C6H13N3O3
and a molecular weight of 175.19 g/mol. Its IUPAC name is amino (2R)-5-amino-2-formamidopentanoate.
Molecular Properties
| Compound Name | amino (2R)-5-amino-2-formamidopentanoate |
| PubChem CID | 174668707 |
| Molecular Formula | C6H13N3O3 |
| Molecular Weight | 175.19 g/mol |
| Exact Mass | 175.10 |
| IUPAC Name | amino (2R)-5-amino-2-formamidopentanoate |
| SMILES | NCCC[C@@H](NC=O)C(=O)ON |
| InChI | InChI=1S/C6H13N3O3/c7-3-1-2-5(9-4-10)6(11)12-8/h4-5H,1-3,7-8H2,(H,9,10)/t5-/m1/s1 |
| InChIKey | JVLNSKHJNTVFNW-RXMQYKEDSA-N |
| XLogP | -1.74 |
| TPSA | 107.44 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 175.19 |
| LogP ≤ 5 | -1.74 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze amino (2R)-5-amino-2-formamidopentanoate with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of amino (2R)-5-amino-2-formamidopentanoate?
The IUPAC name of amino (2R)-5-amino-2-formamidopentanoate (CID 174668707) is amino (2R)-5-amino-2-formamidopentanoate.
What is the SMILES notation for amino (2R)-5-amino-2-formamidopentanoate?
The canonical SMILES for amino (2R)-5-amino-2-formamidopentanoate is NCCC[C@@H](NC=O)C(=O)ON.
What is the InChIKey of amino (2R)-5-amino-2-formamidopentanoate?
The InChIKey is JVLNSKHJNTVFNW-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H13N3O3/c7-3-1-2-5(9-4-10)6(11)12-8/h4-5H,1-3,7-8H2,(H,9,10)/t5-/m1/s1.
What are the key properties of amino (2R)-5-amino-2-formamidopentanoate?
amino (2R)-5-amino-2-formamidopentanoate has a molecular weight of 175.19 g/mol, XLogP of -1.74, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for amino (2R)-5-amino-2-formamidopentanoate is sourced from PubChem (CID 174668707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).