cyclohexen-1-yl-(4-ethoxyphenyl)methanol

C15H20O2 — CID 55033893

IUPACcyclohexen-1-yl-(4-ethoxyphenyl)methanol
SMILESCCOc1ccc(C(O)C2=CCCCC2)cc1
InChIInChI=1S/C15H20O2/c1-2-17-14-10-8-13(9-11-14)15(16)12-6-4-3-5-7-12/h6,8-11,15-16H,2-5,7H2,1H3
InChIKeyGLRDMLUVHBSTRJ-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.62
Rot. Bonds4

About cyclohexen-1-yl-(4-ethoxyphenyl)methanol

cyclohexen-1-yl-(4-ethoxyphenyl)methanol (PubChem CID 55033893) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is cyclohexen-1-yl-(4-ethoxyphenyl)methanol.

Molecular Properties

Compound Namecyclohexen-1-yl-(4-ethoxyphenyl)methanol
PubChem CID55033893
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Namecyclohexen-1-yl-(4-ethoxyphenyl)methanol
SMILESCCOc1ccc(C(O)C2=CCCCC2)cc1
InChIInChI=1S/C15H20O2/c1-2-17-14-10-8-13(9-11-14)15(16)12-6-4-3-5-7-12/h6,8-11,15-16H,2-5,7H2,1H3
InChIKeyGLRDMLUVHBSTRJ-UHFFFAOYSA-N
XLogP3.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(4-butoxyphenyl)-(cyclohepten-1-yl)methanol
CID 106657772
[(1E)-cycloocten-1-yl]-(4-propoxyphenyl)methanol
CID 106650925
[(1E)-cycloocten-1-yl]-(3-ethoxyphenyl)methanol
CID 106650934
[(1E)-cycloocten-1-yl]-(4-methylphenyl)methanol
CID 106651010
cyclohexen-1-yl-(6-methoxy-3-pyridinyl)methanol
CID 106651682
amino-(4-ethoxyphenyl)methanol
CID 116939610
[(1E)-cycloocten-1-yl]-(4-fluoro-3-methoxyphenyl)methanol
CID 106657566
2-(cyclohexen-1-yl)-1-(4-ethoxyphenyl)-N-methylethanamine
CID 116661553
cyclohexen-1-yl(cyclopenten-1-yl)methanol
CID 19798316
(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502
2-(cyclohexen-1-yl)-1-(4-ethoxyphenyl)-N-ethylethanamine
CID 116661833
cyclopenten-1-yl(phenyl)methanol
CID 62079270

Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl-(4-ethoxyphenyl)methanol?
The IUPAC name of cyclohexen-1-yl-(4-ethoxyphenyl)methanol (CID 55033893) is cyclohexen-1-yl-(4-ethoxyphenyl)methanol.
What is the SMILES notation for cyclohexen-1-yl-(4-ethoxyphenyl)methanol?
The canonical SMILES for cyclohexen-1-yl-(4-ethoxyphenyl)methanol is CCOc1ccc(C(O)C2=CCCCC2)cc1.
What is the InChIKey of cyclohexen-1-yl-(4-ethoxyphenyl)methanol?
The InChIKey is GLRDMLUVHBSTRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-2-17-14-10-8-13(9-11-14)15(16)12-6-4-3-5-7-12/h6,8-11,15-16H,2-5,7H2,1H3.
What are the key properties of cyclohexen-1-yl-(4-ethoxyphenyl)methanol?
cyclohexen-1-yl-(4-ethoxyphenyl)methanol has a molecular weight of 232.32 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl-(4-ethoxyphenyl)methanol is sourced from PubChem (CID 55033893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).