2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol

C15H22O2 — CID 107713283

IUPAC2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol
SMILESCC1CCCC(Oc2ccccc2CCO)C1
InChIInChI=1S/C15H22O2/c1-12-5-4-7-14(11-12)17-15-8-3-2-6-13(15)9-10-16/h2-3,6,8,12,14,16H,4-5,7,9-11H2,1H3
InChIKeyPNFGRPOYJZUKSN-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.18
Rot. Bonds4

About 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol

2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol (PubChem CID 107713283) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol.

Molecular Properties

Compound Name2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol
PubChem CID107713283
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol
SMILESCC1CCCC(Oc2ccccc2CCO)C1
InChIInChI=1S/C15H22O2/c1-12-5-4-7-14(11-12)17-15-8-3-2-6-13(15)9-10-16/h2-3,6,8,12,14,16H,4-5,7,9-11H2,1H3
InChIKeyPNFGRPOYJZUKSN-UHFFFAOYSA-N
XLogP3.18
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol?
The IUPAC name of 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol (CID 107713283) is 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol.
What is the SMILES notation for 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol?
The canonical SMILES for 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol is CC1CCCC(Oc2ccccc2CCO)C1.
What is the InChIKey of 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol?
The InChIKey is PNFGRPOYJZUKSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-12-5-4-7-14(11-12)17-15-8-3-2-6-13(15)9-10-16/h2-3,6,8,12,14,16H,4-5,7,9-11H2,1H3.
What are the key properties of 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol?
2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol has a molecular weight of 234.34 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylcyclohexyl)oxyphenyl]ethanol is sourced from PubChem (CID 107713283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).