2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol

C17H26O2 — CID 62159658

IUPAC2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol
SMILESCOc1ccc(C)cc1CC(O)C1CCC(C)CC1
InChIInChI=1S/C17H26O2/c1-12-4-7-14(8-5-12)16(18)11-15-10-13(2)6-9-17(15)19-3/h6,9-10,12,14,16,18H,4-5,7-8,11H2,1-3H3
InChIKeyVWMVAOWBHGLDRD-UHFFFAOYSA-N
MW262.39 g/mol
LogP3.73
Rot. Bonds4

About 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol

2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol (PubChem CID 62159658) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol.

Molecular Properties

Compound Name2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol
PubChem CID62159658
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol
SMILESCOc1ccc(C)cc1CC(O)C1CCC(C)CC1
InChIInChI=1S/C17H26O2/c1-12-4-7-14(8-5-12)16(18)11-15-10-13(2)6-9-17(15)19-3/h6,9-10,12,14,16,18H,4-5,7-8,11H2,1-3H3
InChIKeyVWMVAOWBHGLDRD-UHFFFAOYSA-N
XLogP3.73
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol?
The IUPAC name of 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol (CID 62159658) is 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol.
What is the SMILES notation for 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol?
The canonical SMILES for 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol is COc1ccc(C)cc1CC(O)C1CCC(C)CC1.
What is the InChIKey of 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol?
The InChIKey is VWMVAOWBHGLDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-12-4-7-14(8-5-12)16(18)11-15-10-13(2)6-9-17(15)19-3/h6,9-10,12,14,16,18H,4-5,7-8,11H2,1-3H3.
What are the key properties of 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol?
2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol has a molecular weight of 262.39 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol is sourced from PubChem (CID 62159658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).