About 2-[(2-ethylcyclopentylidene)amino]guanidine
2-[(2-ethylcyclopentylidene)amino]guanidine (PubChem CID 103756414) has the molecular formula C8H16N4
and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-[(2-ethylcyclopentylidene)amino]guanidine.
Molecular Properties
| Compound Name | 2-[(2-ethylcyclopentylidene)amino]guanidine |
| PubChem CID | 103756414 |
| Molecular Formula | C8H16N4 |
| Molecular Weight | 168.24 g/mol |
| Exact Mass | 168.14 |
| IUPAC Name | 2-[(2-ethylcyclopentylidene)amino]guanidine |
| SMILES | CCC1CCCC1=NN=C(N)N |
| InChI | InChI=1S/C8H16N4/c1-2-6-4-3-5-7(6)11-12-8(9)10/h6H,2-5H2,1H3,(H4,9,10,12) |
| InChIKey | CIIVAXAKOBDEKC-UHFFFAOYSA-N |
| XLogP | 0.83 |
| TPSA | 76.76 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 168.24 |
| LogP ≤ 5 | 0.83 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-[(2-ethylcyclopentylidene)amino]guanidine?
The IUPAC name of 2-[(2-ethylcyclopentylidene)amino]guanidine (CID 103756414) is 2-[(2-ethylcyclopentylidene)amino]guanidine.
What is the SMILES notation for 2-[(2-ethylcyclopentylidene)amino]guanidine?
The canonical SMILES for 2-[(2-ethylcyclopentylidene)amino]guanidine is CCC1CCCC1=NN=C(N)N.
What is the InChIKey of 2-[(2-ethylcyclopentylidene)amino]guanidine?
The InChIKey is CIIVAXAKOBDEKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4/c1-2-6-4-3-5-7(6)11-12-8(9)10/h6H,2-5H2,1H3,(H4,9,10,12).
What are the key properties of 2-[(2-ethylcyclopentylidene)amino]guanidine?
2-[(2-ethylcyclopentylidene)amino]guanidine has a molecular weight of 168.24 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethylcyclopentylidene)amino]guanidine is sourced from PubChem (CID 103756414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).