4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol

C13H19NO2 — CID 165429310

IUPAC4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol
SMILESCN1CCC[C@@H](COc2ccc(O)cc2)C1
InChIInChI=1S/C13H19NO2/c1-14-8-2-3-11(9-14)10-16-13-6-4-12(15)5-7-13/h4-7,11,15H,2-3,8-10H2,1H3/t11-/m1/s1
InChIKeyMUOXEFGRKYUGGR-LLVKDONJSA-N
MW221.30 g/mol
LogP2.11
Rot. Bonds3

About 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol

4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol (PubChem CID 165429310) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol.

Molecular Properties

Compound Name4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol
PubChem CID165429310
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol
SMILESCN1CCC[C@@H](COc2ccc(O)cc2)C1
InChIInChI=1S/C13H19NO2/c1-14-8-2-3-11(9-14)10-16-13-6-4-12(15)5-7-13/h4-7,11,15H,2-3,8-10H2,1H3/t11-/m1/s1
InChIKeyMUOXEFGRKYUGGR-LLVKDONJSA-N
XLogP2.11
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-[[4-[(E)-2-phenylethenyl]phenoxy]methyl]piperidine
CID 134126084
N-hydroxy-N'-[4-[(1-methylpiperidin-3-yl)methoxy]phenyl]methanimidamide
CID 20763511
4-[[4-[(4-hydroxyphenoxy)methyl]cyclohexyl]methoxy]phenol
CID 118229789
4-(cyclopropylmethoxy)-N-methyl-N-[(1-methylpiperidin-3-yl)methyl]benzamide
CID 136526082
(3S)-3-[(3-iodophenoxy)methyl]-1-methylpiperidine
CID 165429240
7-[(1-methylpiperidin-3-yl)methoxy]-1,2,3,4-tetrahydroisoquinoline
CID 115076629
1-[4-[(1-methylpyrrolidin-3-yl)methoxy]phenyl]ethanamine
CID 117052228
(3S)-3-(methoxymethyl)-1-methylpiperidine
CID 58134332
2,3-dihydro-1,4-benzodioxine;(3S)-1-methyl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine;trifluoromethylbenzene
CID 142125090
4-[2-hydroxy-2-(1-methylpyrrolidin-3-yl)ethoxy]phenol
CID 117237471
cyclopropyl-[3-[(4-methylphenoxy)methyl]piperidin-1-yl]methanone
CID 110638549
1-bromo-4-(cyclobutylmethoxy)benzene;bromomethylcyclobutane;4-bromophenol
CID 161332440

Frequently Asked Questions

What is the IUPAC name of 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol?
The IUPAC name of 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol (CID 165429310) is 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol.
What is the SMILES notation for 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol?
The canonical SMILES for 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol is CN1CCC[C@@H](COc2ccc(O)cc2)C1.
What is the InChIKey of 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol?
The InChIKey is MUOXEFGRKYUGGR-LLVKDONJSA-N. The full InChI is InChI=1S/C13H19NO2/c1-14-8-2-3-11(9-14)10-16-13-6-4-12(15)5-7-13/h4-7,11,15H,2-3,8-10H2,1H3/t11-/m1/s1.
What are the key properties of 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol?
4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol has a molecular weight of 221.30 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(3R)-1-methylpiperidin-3-yl]methoxy]phenol is sourced from PubChem (CID 165429310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).