[3-(4-ethoxyphenyl)piperidin-4-yl]methanol

C14H21NO2 — CID 117000508

IUPAC[3-(4-ethoxyphenyl)piperidin-4-yl]methanol
SMILESCCOc1ccc(C2CNCCC2CO)cc1
InChIInChI=1S/C14H21NO2/c1-2-17-13-5-3-11(4-6-13)14-9-15-8-7-12(14)10-16/h3-6,12,14-16H,2,7-10H2,1H3
InChIKeyOQBDWOYERZUUAL-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.77
Rot. Bonds4

About [3-(4-ethoxyphenyl)piperidin-4-yl]methanol

[3-(4-ethoxyphenyl)piperidin-4-yl]methanol (PubChem CID 117000508) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is [3-(4-ethoxyphenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[3-(4-ethoxyphenyl)piperidin-4-yl]methanol
PubChem CID117000508
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name[3-(4-ethoxyphenyl)piperidin-4-yl]methanol
SMILESCCOc1ccc(C2CNCCC2CO)cc1
InChIInChI=1S/C14H21NO2/c1-2-17-13-5-3-11(4-6-13)14-9-15-8-7-12(14)10-16/h3-6,12,14-16H,2,7-10H2,1H3
InChIKeyOQBDWOYERZUUAL-UHFFFAOYSA-N
XLogP1.77
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-ethoxyphenyl)piperidine
CID 21495191
(3R,4R)-4-(4-ethoxyphenyl)pyrrolidin-3-amine
CID 129359671
4-methyl-3-(4-propoxyphenyl)piperidine
CID 66274020
(3R)-3-[(4-ethoxyphenoxy)methyl]pyrrolidine
CID 86321325
3-[(4-ethoxyphenoxy)methyl]pyrrolidine;hydrochloride
CID 56830321
(3S,4R)-4-(4-ethoxyphenyl)pyrrolidine-3-carbonitrile
CID 129493041
4-ethyl-3-phenylpiperidine
CID 175022073
7-[4-(4-ethoxyphenoxy)piperidin-3-yl]naphthalen-1-ol
CID 173058902
4-[(4-ethoxyphenyl)methyl]piperidine
CID 4778265
2-(4-ethoxyphenyl)cyclohexan-1-amine
CID 62800786
4-[[(4R)-4-(4-butoxyphenyl)piperidin-3-yl]methoxy]benzamide
CID 145270513
2-[4-(hydroxymethyl)piperidin-3-yl]phenol
CID 117168009

Frequently Asked Questions

What is the IUPAC name of [3-(4-ethoxyphenyl)piperidin-4-yl]methanol?
The IUPAC name of [3-(4-ethoxyphenyl)piperidin-4-yl]methanol (CID 117000508) is [3-(4-ethoxyphenyl)piperidin-4-yl]methanol.
What is the SMILES notation for [3-(4-ethoxyphenyl)piperidin-4-yl]methanol?
The canonical SMILES for [3-(4-ethoxyphenyl)piperidin-4-yl]methanol is CCOc1ccc(C2CNCCC2CO)cc1.
What is the InChIKey of [3-(4-ethoxyphenyl)piperidin-4-yl]methanol?
The InChIKey is OQBDWOYERZUUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-17-13-5-3-11(4-6-13)14-9-15-8-7-12(14)10-16/h3-6,12,14-16H,2,7-10H2,1H3.
What are the key properties of [3-(4-ethoxyphenyl)piperidin-4-yl]methanol?
[3-(4-ethoxyphenyl)piperidin-4-yl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-ethoxyphenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 117000508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).