2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol

C14H21NO3 — CID 117238836

IUPAC2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol
SMILESCOc1cccc(OCC(O)C2CCNCC2)c1
InChIInChI=1S/C14H21NO3/c1-17-12-3-2-4-13(9-12)18-10-14(16)11-5-7-15-8-6-11/h2-4,9,11,14-16H,5-8,10H2,1H3
InChIKeyNPDBGNRTYYVPER-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.43
Rot. Bonds5

About 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol

2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol (PubChem CID 117238836) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol
PubChem CID117238836
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol
SMILESCOc1cccc(OCC(O)C2CCNCC2)c1
InChIInChI=1S/C14H21NO3/c1-17-12-3-2-4-13(9-12)18-10-14(16)11-5-7-15-8-6-11/h2-4,9,11,14-16H,5-8,10H2,1H3
InChIKeyNPDBGNRTYYVPER-UHFFFAOYSA-N
XLogP1.43
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyphenoxy)-1-(oxolan-3-yl)ethanol
CID 113449272
2-(4-methoxyphenoxy)-1-pyrrolidin-3-ylethanol
CID 117237470
4-[2-(3-methoxyphenoxy)ethyl]piperidine
CID 26192450
1-cyclobutyl-2-(3-methylphenoxy)ethanol
CID 117245576
2-(3-chlorophenoxy)-1-cyclopropylethanol
CID 105105371
3-(2-cyclopentyl-2-hydroxyethoxy)phenol
CID 117245767
(3S)-3-[2-(3-methoxyphenoxy)ethyl]pyrrolidine
CID 93080822
1-cyclopropyl-3-(3-methoxyphenyl)propan-1-ol
CID 63354159
3-[1-(3-methoxyphenoxy)ethyl]pyrrolidine
CID 105477836
methyl 3-(3-chlorophenoxy)-2-piperidin-4-ylpropanoate
CID 117239760
N-[3-(3-methoxyphenoxy)propyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119797678
(4-methoxy-2-methylphenyl)-piperidin-4-ylmethanol
CID 80560362

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol?
The IUPAC name of 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol (CID 117238836) is 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol.
What is the SMILES notation for 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol?
The canonical SMILES for 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol is COc1cccc(OCC(O)C2CCNCC2)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol?
The InChIKey is NPDBGNRTYYVPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-17-12-3-2-4-13(9-12)18-10-14(16)11-5-7-15-8-6-11/h2-4,9,11,14-16H,5-8,10H2,1H3.
What are the key properties of 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol?
2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol has a molecular weight of 251.33 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol is sourced from PubChem (CID 117238836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).