1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol

C14H20O3 — CID 43503851

IUPAC1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol
SMILESCOc1cc(C(C)O)ccc1OC1CCCC1
InChIInChI=1S/C14H20O3/c1-10(15)11-7-8-13(14(9-11)16-2)17-12-5-3-4-6-12/h7-10,12,15H,3-6H2,1-2H3
InChIKeyONQYMJHLPYDALT-UHFFFAOYSA-N
MW236.31 g/mol
LogP3.07
Rot. Bonds4

About 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol

1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol (PubChem CID 43503851) has the molecular formula C14H20O3 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol
PubChem CID43503851
Molecular FormulaC14H20O3
Molecular Weight236.31 g/mol
Exact Mass236.14
IUPAC Name1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol
SMILESCOc1cc(C(C)O)ccc1OC1CCCC1
InChIInChI=1S/C14H20O3/c1-10(15)11-7-8-13(14(9-11)16-2)17-12-5-3-4-6-12/h7-10,12,15H,3-6H2,1-2H3
InChIKeyONQYMJHLPYDALT-UHFFFAOYSA-N
XLogP3.07
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol?
The IUPAC name of 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol (CID 43503851) is 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol is COc1cc(C(C)O)ccc1OC1CCCC1.
What is the InChIKey of 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol?
The InChIKey is ONQYMJHLPYDALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O3/c1-10(15)11-7-8-13(14(9-11)16-2)17-12-5-3-4-6-12/h7-10,12,15H,3-6H2,1-2H3.
What are the key properties of 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol?
1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol has a molecular weight of 236.31 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol is sourced from PubChem (CID 43503851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).