About 4-methylimidazolidine
4-methylimidazolidine (PubChem CID 20671529) has the molecular formula C4H10N2
and a molecular weight of 86.14 g/mol. Its IUPAC name is 4-methylimidazolidine.
Molecular Properties
| Compound Name | 4-methylimidazolidine |
| PubChem CID | 20671529 |
| Molecular Formula | C4H10N2 |
| Molecular Weight | 86.14 g/mol |
| Exact Mass | 86.08 |
| IUPAC Name | 4-methylimidazolidine |
| SMILES | CC1CNCN1 |
| InChI | InChI=1S/C4H10N2/c1-4-2-5-3-6-4/h4-6H,2-3H2,1H3 |
| InChIKey | VGBASMXDKFZLAK-UHFFFAOYSA-N |
| XLogP | -0.47 |
| TPSA | 24.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 86.14 |
| LogP ≤ 5 | -0.47 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-methylimidazolidine?
The IUPAC name of 4-methylimidazolidine (CID 20671529) is 4-methylimidazolidine.
What is the SMILES notation for 4-methylimidazolidine?
The canonical SMILES for 4-methylimidazolidine is CC1CNCN1.
What is the InChIKey of 4-methylimidazolidine?
The InChIKey is VGBASMXDKFZLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2/c1-4-2-5-3-6-4/h4-6H,2-3H2,1H3.
What are the key properties of 4-methylimidazolidine?
4-methylimidazolidine has a molecular weight of 86.14 g/mol, XLogP of -0.47, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylimidazolidine is sourced from PubChem (CID 20671529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).