1-cyclopentyl-2-(2-propoxyphenoxy)ethanol

C16H24O3 — CID 104753565

IUPAC1-cyclopentyl-2-(2-propoxyphenoxy)ethanol
SMILESCCCOc1ccccc1OCC(O)C1CCCC1
InChIInChI=1S/C16H24O3/c1-2-11-18-15-9-5-6-10-16(15)19-12-14(17)13-7-3-4-8-13/h5-6,9-10,13-14,17H,2-4,7-8,11-12H2,1H3
InChIKeyYSOLCJFYDPXOHV-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.41
Rot. Bonds7

About 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol

1-cyclopentyl-2-(2-propoxyphenoxy)ethanol (PubChem CID 104753565) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-propoxyphenoxy)ethanol
PubChem CID104753565
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name1-cyclopentyl-2-(2-propoxyphenoxy)ethanol
SMILESCCCOc1ccccc1OCC(O)C1CCCC1
InChIInChI=1S/C16H24O3/c1-2-11-18-15-9-5-6-10-16(15)19-12-14(17)13-7-3-4-8-13/h5-6,9-10,13-14,17H,2-4,7-8,11-12H2,1H3
InChIKeyYSOLCJFYDPXOHV-UHFFFAOYSA-N
XLogP3.41
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-(2-methoxyphenoxy)ethanol
CID 113449278
1-cyclopentyl-2-naphthalen-1-yloxyethanol
CID 104753513
1-cyclopropyl-2-(2-propoxyphenoxy)ethanamine
CID 63913161
(3-methylcyclohexyl)-(2-propoxyphenyl)methanol
CID 104658787
1-cyclobutyl-2-[2-(trifluoromethyl)phenoxy]ethanol
CID 117245560
1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol
CID 117238772
2-[2-hydroxy-2-(1-methylpiperidin-4-yl)ethoxy]phenol
CID 117238747
N-[3-(2-propoxyphenoxy)propyl]cyclohexanamine
CID 62573100
2-[2-(1-ethylpiperidin-4-yl)-2-hydroxyethoxy]phenol
CID 117238771
1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol
CID 104753531
2-(2-fluorophenoxy)-1-(1-methylpiperidin-4-yl)ethanol
CID 117238738
N-cyclohexyl-2-propoxyaniline
CID 43682292

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol?
The IUPAC name of 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol (CID 104753565) is 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol.
What is the SMILES notation for 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol?
The canonical SMILES for 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol is CCCOc1ccccc1OCC(O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol?
The InChIKey is YSOLCJFYDPXOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O3/c1-2-11-18-15-9-5-6-10-16(15)19-12-14(17)13-7-3-4-8-13/h5-6,9-10,13-14,17H,2-4,7-8,11-12H2,1H3.
What are the key properties of 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol?
1-cyclopentyl-2-(2-propoxyphenoxy)ethanol has a molecular weight of 264.37 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-propoxyphenoxy)ethanol is sourced from PubChem (CID 104753565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).