About 2-(4-methyl-2-propylpentyl)pyridine
2-(4-methyl-2-propylpentyl)pyridine (PubChem CID 57227935) has the molecular formula C14H23N
and a molecular weight of 205.34 g/mol. Its IUPAC name is 2-(4-methyl-2-propylpentyl)pyridine.
Molecular Properties
| Compound Name | 2-(4-methyl-2-propylpentyl)pyridine |
| PubChem CID | 57227935 |
| Molecular Formula | C14H23N |
| Molecular Weight | 205.34 g/mol |
| Exact Mass | 205.18 |
| IUPAC Name | 2-(4-methyl-2-propylpentyl)pyridine |
| SMILES | CCCC(Cc1ccccn1)CC(C)C |
| InChI | InChI=1S/C14H23N/c1-4-7-13(10-12(2)3)11-14-8-5-6-9-15-14/h5-6,8-9,12-13H,4,7,10-11H2,1-3H3 |
| InChIKey | XIMXRWPLSUOSPQ-UHFFFAOYSA-N |
| XLogP | 4.09 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 205.34 |
| LogP ≤ 5 | 4.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-methyl-2-propylpentyl)pyridine?
The IUPAC name of 2-(4-methyl-2-propylpentyl)pyridine (CID 57227935) is 2-(4-methyl-2-propylpentyl)pyridine.
What is the SMILES notation for 2-(4-methyl-2-propylpentyl)pyridine?
The canonical SMILES for 2-(4-methyl-2-propylpentyl)pyridine is CCCC(Cc1ccccn1)CC(C)C.
What is the InChIKey of 2-(4-methyl-2-propylpentyl)pyridine?
The InChIKey is XIMXRWPLSUOSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-4-7-13(10-12(2)3)11-14-8-5-6-9-15-14/h5-6,8-9,12-13H,4,7,10-11H2,1-3H3.
What are the key properties of 2-(4-methyl-2-propylpentyl)pyridine?
2-(4-methyl-2-propylpentyl)pyridine has a molecular weight of 205.34 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2-propylpentyl)pyridine is sourced from PubChem (CID 57227935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).