About 1-(3-methylheptan-2-yl)imidazolidine
1-(3-methylheptan-2-yl)imidazolidine (PubChem CID 174705189) has the molecular formula C11H24N2
and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-(3-methylheptan-2-yl)imidazolidine.
Molecular Properties
| Compound Name | 1-(3-methylheptan-2-yl)imidazolidine |
| PubChem CID | 174705189 |
| Molecular Formula | C11H24N2 |
| Molecular Weight | 184.33 g/mol |
| Exact Mass | 184.19 |
| IUPAC Name | 1-(3-methylheptan-2-yl)imidazolidine |
| SMILES | CCCCC(C)C(C)N1CCNC1 |
| InChI | InChI=1S/C11H24N2/c1-4-5-6-10(2)11(3)13-8-7-12-9-13/h10-12H,4-9H2,1-3H3 |
| InChIKey | GHVTVHYCAKWWBS-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 184.33 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(3-methylheptan-2-yl)imidazolidine?
The IUPAC name of 1-(3-methylheptan-2-yl)imidazolidine (CID 174705189) is 1-(3-methylheptan-2-yl)imidazolidine.
What is the SMILES notation for 1-(3-methylheptan-2-yl)imidazolidine?
The canonical SMILES for 1-(3-methylheptan-2-yl)imidazolidine is CCCCC(C)C(C)N1CCNC1.
What is the InChIKey of 1-(3-methylheptan-2-yl)imidazolidine?
The InChIKey is GHVTVHYCAKWWBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-5-6-10(2)11(3)13-8-7-12-9-13/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-(3-methylheptan-2-yl)imidazolidine?
1-(3-methylheptan-2-yl)imidazolidine has a molecular weight of 184.33 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylheptan-2-yl)imidazolidine is sourced from PubChem (CID 174705189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).