4-[(3-methoxyphenoxy)methyl]piperidin-4-ol

C13H19NO3 — CID 81042080

IUPAC4-[(3-methoxyphenoxy)methyl]piperidin-4-ol
SMILESCOc1cccc(OCC2(O)CCNCC2)c1
InChIInChI=1S/C13H19NO3/c1-16-11-3-2-4-12(9-11)17-10-13(15)5-7-14-8-6-13/h2-4,9,14-15H,5-8,10H2,1H3
InChIKeyRVJALVMKQDYXPJ-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.19
Rot. Bonds4

About 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol

4-[(3-methoxyphenoxy)methyl]piperidin-4-ol (PubChem CID 81042080) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[(3-methoxyphenoxy)methyl]piperidin-4-ol
PubChem CID81042080
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name4-[(3-methoxyphenoxy)methyl]piperidin-4-ol
SMILESCOc1cccc(OCC2(O)CCNCC2)c1
InChIInChI=1S/C13H19NO3/c1-16-11-3-2-4-12(9-11)17-10-13(15)5-7-14-8-6-13/h2-4,9,14-15H,5-8,10H2,1H3
InChIKeyRVJALVMKQDYXPJ-UHFFFAOYSA-N
XLogP1.19
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3,5-dimethoxyphenoxy)methyl]piperidin-4-ol
CID 81042741
1-[(3-methoxyphenoxy)methyl]cyclohexan-1-ol
CID 65213494
4-[(3-ethylphenoxy)methyl]piperidin-4-ol
CID 81043219
4-[(2-bromo-4-methoxyphenoxy)methyl]piperidin-4-ol
CID 104707744
4-hydroxy-4-[(3-methoxyphenoxy)methyl]cyclohexane-1-carboxylic acid
CID 106497082
4-[[(3-methoxyphenyl)methyl-methylamino]methyl]piperidin-4-ol
CID 62221334
4-(pyridin-3-yloxymethyl)piperidin-4-ol
CID 112703881
1-[(3-propoxyphenoxy)methyl]cyclopentan-1-ol
CID 69097510
1-[(3-propoxyphenoxy)methyl]cyclohexan-1-ol
CID 69097328
(3-methoxyphenoxy)methanol
CID 10442564
2-(3-methoxyphenoxy)-1-piperidin-4-ylethanol
CID 117238836
1-(bromomethyl)-1-[(3-methoxyphenoxy)methyl]cycloheptane
CID 65009956

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol?
The IUPAC name of 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol (CID 81042080) is 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol.
What is the SMILES notation for 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol?
The canonical SMILES for 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol is COc1cccc(OCC2(O)CCNCC2)c1.
What is the InChIKey of 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol?
The InChIKey is RVJALVMKQDYXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-16-11-3-2-4-12(9-11)17-10-13(15)5-7-14-8-6-13/h2-4,9,14-15H,5-8,10H2,1H3.
What are the key properties of 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol?
4-[(3-methoxyphenoxy)methyl]piperidin-4-ol has a molecular weight of 237.30 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methoxyphenoxy)methyl]piperidin-4-ol is sourced from PubChem (CID 81042080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).