2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol

C15H22O2 — CID 107183403

IUPAC2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol
SMILESCOc1ccc(CC(O)C2CCCC2C)cc1
InChIInChI=1S/C15H22O2/c1-11-4-3-5-14(11)15(16)10-12-6-8-13(17-2)9-7-12/h6-9,11,14-16H,3-5,10H2,1-2H3
InChIKeyHXMSJUWAEAFDRV-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.03
Rot. Bonds4

About 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol

2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol (PubChem CID 107183403) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol
PubChem CID107183403
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol
SMILESCOc1ccc(CC(O)C2CCCC2C)cc1
InChIInChI=1S/C15H22O2/c1-11-4-3-5-14(11)15(16)10-12-6-8-13(17-2)9-7-12/h6-9,11,14-16H,3-5,10H2,1-2H3
InChIKeyHXMSJUWAEAFDRV-UHFFFAOYSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol?
The IUPAC name of 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol (CID 107183403) is 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol.
What is the SMILES notation for 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol?
The canonical SMILES for 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol is COc1ccc(CC(O)C2CCCC2C)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol?
The InChIKey is HXMSJUWAEAFDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-11-4-3-5-14(11)15(16)10-12-6-8-13(17-2)9-7-12/h6-9,11,14-16H,3-5,10H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol?
2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol has a molecular weight of 234.34 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-1-(2-methylcyclopentyl)ethanol is sourced from PubChem (CID 107183403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).