1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol

C15H22O2 — CID 62788999

IUPAC1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol
SMILESCCOc1ccc(C2(O)CCC(C)CC2)cc1
InChIInChI=1S/C15H22O2/c1-3-17-14-6-4-13(5-7-14)15(16)10-8-12(2)9-11-15/h4-7,12,16H,3,8-11H2,1-2H3
InChIKeyWTNFAHIKOSYPCO-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.48
Rot. Bonds3

About 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol

1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol (PubChem CID 62788999) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol
PubChem CID62788999
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol
SMILESCCOc1ccc(C2(O)CCC(C)CC2)cc1
InChIInChI=1S/C15H22O2/c1-3-17-14-6-4-13(5-7-14)15(16)10-8-12(2)9-11-15/h4-7,12,16H,3,8-11H2,1-2H3
InChIKeyWTNFAHIKOSYPCO-UHFFFAOYSA-N
XLogP3.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol?
The IUPAC name of 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol (CID 62788999) is 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol.
What is the SMILES notation for 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol?
The canonical SMILES for 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol is CCOc1ccc(C2(O)CCC(C)CC2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol?
The InChIKey is WTNFAHIKOSYPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-3-17-14-6-4-13(5-7-14)15(16)10-8-12(2)9-11-15/h4-7,12,16H,3,8-11H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol?
1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol is sourced from PubChem (CID 62788999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).