About (4-cyclohexylphenyl)-pyridin-4-ylmethanone
(4-cyclohexylphenyl)-pyridin-4-ylmethanone (PubChem CID 43160506) has the molecular formula C18H19NO
and a molecular weight of 265.36 g/mol. Its IUPAC name is (4-cyclohexylphenyl)-pyridin-4-ylmethanone.
Molecular Properties
| Compound Name | (4-cyclohexylphenyl)-pyridin-4-ylmethanone |
| PubChem CID | 43160506 |
| Molecular Formula | C18H19NO |
| Molecular Weight | 265.36 g/mol |
| Exact Mass | 265.15 |
| IUPAC Name | (4-cyclohexylphenyl)-pyridin-4-ylmethanone |
| SMILES | O=C(c1ccncc1)c1ccc(C2CCCCC2)cc1 |
| InChI | InChI=1S/C18H19NO/c20-18(17-10-12-19-13-11-17)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14H,1-5H2 |
| InChIKey | JBWPVSNJSFUGNC-UHFFFAOYSA-N |
| XLogP | 4.36 |
| TPSA | 29.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 265.36 |
| LogP ≤ 5 | 4.36 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
The IUPAC name of (4-cyclohexylphenyl)-pyridin-4-ylmethanone (CID 43160506) is (4-cyclohexylphenyl)-pyridin-4-ylmethanone.
What is the SMILES notation for (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
The canonical SMILES for (4-cyclohexylphenyl)-pyridin-4-ylmethanone is O=C(c1ccncc1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
The InChIKey is JBWPVSNJSFUGNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c20-18(17-10-12-19-13-11-17)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-14H,1-5H2.
What are the key properties of (4-cyclohexylphenyl)-pyridin-4-ylmethanone?
(4-cyclohexylphenyl)-pyridin-4-ylmethanone has a molecular weight of 265.36 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclohexylphenyl)-pyridin-4-ylmethanone is sourced from PubChem (CID 43160506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).