1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol

C16H25NO3 — CID 117238772

IUPAC1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol
SMILESCCN1CCC(C(O)COc2ccccc2OC)CC1
InChIInChI=1S/C16H25NO3/c1-3-17-10-8-13(9-11-17)14(18)12-20-16-7-5-4-6-15(16)19-2/h4-7,13-14,18H,3,8-12H2,1-2H3
InChIKeyTYXMDXDDCLJWCV-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.17
Rot. Bonds6

About 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol

1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol (PubChem CID 117238772) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol.

Molecular Properties

Compound Name1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol
PubChem CID117238772
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol
SMILESCCN1CCC(C(O)COc2ccccc2OC)CC1
InChIInChI=1S/C16H25NO3/c1-3-17-10-8-13(9-11-17)14(18)12-20-16-7-5-4-6-15(16)19-2/h4-7,13-14,18H,3,8-12H2,1-2H3
InChIKeyTYXMDXDDCLJWCV-UHFFFAOYSA-N
XLogP2.17
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(1-ethylpiperidin-4-yl)-2-hydroxyethoxy]phenol
CID 117238771
1-cyclopentyl-2-(2-methoxyphenoxy)ethanol
CID 113449278
2-(2-methoxyphenoxy)-1-(thiolan-3-yl)ethanol
CID 117237270
2-[2-hydroxy-2-(1-methylpiperidin-4-yl)ethoxy]phenol
CID 117238747
1-cyclopentyl-2-(2-propoxyphenoxy)ethanol
CID 104753565
2-(2-fluorophenoxy)-1-(1-methylpiperidin-4-yl)ethanol
CID 117238738
3-(2-chlorophenoxy)-2-(1-ethylpiperidin-4-yl)propan-1-ol
CID 117239259
1-[(2-cyclopropyl-2-hydroxyethyl)amino]-3-(2-methoxyphenoxy)propan-2-ol
CID 63296623
3-(2-methoxyphenoxy)-2-(1-propan-2-ylpyrrolidin-3-yl)propan-1-ol
CID 117237826
N-[(1-ethylpiperidin-4-yl)methyl]-2-(2-methoxyphenoxy)acetamide
CID 51092761
1-cyclopentyl-3-(2-methoxyphenoxy)propan-2-ol
CID 103160603
1-cyclopropyl-2-(2-methoxy-4-methylphenoxy)ethanol
CID 63907448

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol?
The IUPAC name of 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol (CID 117238772) is 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol.
What is the SMILES notation for 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol?
The canonical SMILES for 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol is CCN1CCC(C(O)COc2ccccc2OC)CC1.
What is the InChIKey of 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol?
The InChIKey is TYXMDXDDCLJWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-3-17-10-8-13(9-11-17)14(18)12-20-16-7-5-4-6-15(16)19-2/h4-7,13-14,18H,3,8-12H2,1-2H3.
What are the key properties of 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol?
1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol has a molecular weight of 279.38 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpiperidin-4-yl)-2-(2-methoxyphenoxy)ethanol is sourced from PubChem (CID 117238772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).