1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol

C15H22O2 — CID 106873797

IUPAC1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol
SMILESCCc1cccc(C2(O)CCCCC2OC)c1
InChIInChI=1S/C15H22O2/c1-3-12-7-6-8-13(11-12)15(16)10-5-4-9-14(15)17-2/h6-8,11,14,16H,3-5,9-10H2,1-2H3
InChIKeyMCAGGAUVXXVEOK-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.03
Rot. Bonds3

About 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol

1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol (PubChem CID 106873797) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol.

Molecular Properties

Compound Name1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol
PubChem CID106873797
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol
SMILESCCc1cccc(C2(O)CCCCC2OC)c1
InChIInChI=1S/C15H22O2/c1-3-12-7-6-8-13(11-12)15(16)10-5-4-9-14(15)17-2/h6-8,11,14,16H,3-5,9-10H2,1-2H3
InChIKeyMCAGGAUVXXVEOK-UHFFFAOYSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol?
The IUPAC name of 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol (CID 106873797) is 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol.
What is the SMILES notation for 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol?
The canonical SMILES for 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol is CCc1cccc(C2(O)CCCCC2OC)c1.
What is the InChIKey of 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol?
The InChIKey is MCAGGAUVXXVEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-3-12-7-6-8-13(11-12)15(16)10-5-4-9-14(15)17-2/h6-8,11,14,16H,3-5,9-10H2,1-2H3.
What are the key properties of 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol?
1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylphenyl)-2-methoxycyclohexan-1-ol is sourced from PubChem (CID 106873797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).