About 5-[(2-methylcyclopentyl)amino]pentanoic acid
5-[(2-methylcyclopentyl)amino]pentanoic acid (PubChem CID 103251309) has the molecular formula C11H21NO2
and a molecular weight of 199.29 g/mol. Its IUPAC name is 5-[(2-methylcyclopentyl)amino]pentanoic acid.
Molecular Properties
| Compound Name | 5-[(2-methylcyclopentyl)amino]pentanoic acid |
| PubChem CID | 103251309 |
| Molecular Formula | C11H21NO2 |
| Molecular Weight | 199.29 g/mol |
| Exact Mass | 199.16 |
| IUPAC Name | 5-[(2-methylcyclopentyl)amino]pentanoic acid |
| SMILES | CC1CCCC1NCCCCC(=O)O |
| InChI | InChI=1S/C11H21NO2/c1-9-5-4-6-10(9)12-8-3-2-7-11(13)14/h9-10,12H,2-8H2,1H3,(H,13,14) |
| InChIKey | GLNOUUZCVASFKK-UHFFFAOYSA-N |
| XLogP | 2.02 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.29 |
| LogP ≤ 5 | 2.02 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 5-[(2-methylcyclopentyl)amino]pentanoic acid?
The IUPAC name of 5-[(2-methylcyclopentyl)amino]pentanoic acid (CID 103251309) is 5-[(2-methylcyclopentyl)amino]pentanoic acid.
What is the SMILES notation for 5-[(2-methylcyclopentyl)amino]pentanoic acid?
The canonical SMILES for 5-[(2-methylcyclopentyl)amino]pentanoic acid is CC1CCCC1NCCCCC(=O)O.
What is the InChIKey of 5-[(2-methylcyclopentyl)amino]pentanoic acid?
The InChIKey is GLNOUUZCVASFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9-5-4-6-10(9)12-8-3-2-7-11(13)14/h9-10,12H,2-8H2,1H3,(H,13,14).
What are the key properties of 5-[(2-methylcyclopentyl)amino]pentanoic acid?
5-[(2-methylcyclopentyl)amino]pentanoic acid has a molecular weight of 199.29 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylcyclopentyl)amino]pentanoic acid is sourced from PubChem (CID 103251309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).