About 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane
1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane (PubChem CID 91283171) has the molecular formula C15H30
and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane.
Molecular Properties
| Compound Name | 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane |
| PubChem CID | 91283171 |
| Molecular Formula | C15H30 |
| Molecular Weight | 210.40 g/mol |
| Exact Mass | 210.23 |
| IUPAC Name | 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane |
| SMILES | CCC(C)CCC1CC1CCCC(C)C |
| InChI | InChI=1S/C15H30/c1-5-13(4)9-10-15-11-14(15)8-6-7-12(2)3/h12-15H,5-11H2,1-4H3 |
| InChIKey | QLMGXJDWRAJOOZ-UHFFFAOYSA-N |
| XLogP | 5.28 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 8 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 210.40 |
| LogP ≤ 5 | 5.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
The IUPAC name of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane (CID 91283171) is 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane.
What is the SMILES notation for 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
The canonical SMILES for 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane is CCC(C)CCC1CC1CCCC(C)C.
What is the InChIKey of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
The InChIKey is QLMGXJDWRAJOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-5-13(4)9-10-15-11-14(15)8-6-7-12(2)3/h12-15H,5-11H2,1-4H3.
What are the key properties of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane has a molecular weight of 210.40 g/mol, XLogP of 5.28, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane is sourced from PubChem (CID 91283171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).