4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole

C16H19NO — CID 57041581

IUPAC4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole
SMILESCc1ccc(-c2nc(C3CCCCC3)co2)cc1
InChIInChI=1S/C16H19NO/c1-12-7-9-14(10-8-12)16-17-15(11-18-16)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3
InChIKeyWVOCZZDOVDWSAQ-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.70
Rot. Bonds2

About 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole

4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole (PubChem CID 57041581) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole
PubChem CID57041581
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole
SMILESCc1ccc(-c2nc(C3CCCCC3)co2)cc1
InChIInChI=1S/C16H19NO/c1-12-7-9-14(10-8-12)16-17-15(11-18-16)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3
InChIKeyWVOCZZDOVDWSAQ-UHFFFAOYSA-N
XLogP4.70
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole?
The IUPAC name of 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole (CID 57041581) is 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole.
What is the SMILES notation for 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole?
The canonical SMILES for 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole is Cc1ccc(-c2nc(C3CCCCC3)co2)cc1.
What is the InChIKey of 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole?
The InChIKey is WVOCZZDOVDWSAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-12-7-9-14(10-8-12)16-17-15(11-18-16)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3.
What are the key properties of 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole?
4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole has a molecular weight of 241.33 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-2-(4-methylphenyl)-1,3-oxazole is sourced from PubChem (CID 57041581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).