About 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene
1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene (PubChem CID 175747060) has the molecular formula C21H24O
and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene.
Molecular Properties
| Compound Name | 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene |
| PubChem CID | 175747060 |
| Molecular Formula | C21H24O |
| Molecular Weight | 292.42 g/mol |
| Exact Mass | 292.18 |
| IUPAC Name | 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene |
| SMILES | CC=Cc1ccccc1Oc1ccccc1C1CCCCC1 |
| InChI | InChI=1S/C21H24O/c1-2-10-18-13-6-8-15-20(18)22-21-16-9-7-14-19(21)17-11-4-3-5-12-17/h2,6-10,13-17H,3-5,11-12H2,1H3 |
| InChIKey | IFXVZGAYANZCAY-UHFFFAOYSA-N |
| XLogP | 6.56 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 292.42 |
| LogP ≤ 5 | 6.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
The IUPAC name of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene (CID 175747060) is 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene.
What is the SMILES notation for 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
The canonical SMILES for 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene is CC=Cc1ccccc1Oc1ccccc1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
The InChIKey is IFXVZGAYANZCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24O/c1-2-10-18-13-6-8-15-20(18)22-21-16-9-7-14-19(21)17-11-4-3-5-12-17/h2,6-10,13-17H,3-5,11-12H2,1H3.
What are the key properties of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene has a molecular weight of 292.42 g/mol, XLogP of 6.56, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene is sourced from PubChem (CID 175747060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).