[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol

C14H21NO2 — CID 54793850

IUPAC[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol
SMILESCOc1ccc(CN2CCCC(CO)C2)cc1
InChIInChI=1S/C14H21NO2/c1-17-14-6-4-12(5-7-14)9-15-8-2-3-13(10-15)11-16/h4-7,13,16H,2-3,8-11H2,1H3
InChIKeyALIYBBDZXFIALI-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.90
Rot. Bonds4

About [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol

[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol (PubChem CID 54793850) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol
PubChem CID54793850
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol
SMILESCOc1ccc(CN2CCCC(CO)C2)cc1
InChIInChI=1S/C14H21NO2/c1-17-14-6-4-12(5-7-14)9-15-8-2-3-13(10-15)11-16/h4-7,13,16H,2-3,8-11H2,1H3
InChIKeyALIYBBDZXFIALI-UHFFFAOYSA-N
XLogP1.90
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(3S)-1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol
CID 95165485
(3R)-3-ethyl-1-[(4-methoxyphenyl)methyl]piperidine
CID 129394219
[(3R)-1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanamine
CID 42253835
3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]propan-1-amine
CID 83982840
N-[[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methyl]cyclopropanamine
CID 62580078
methyl 3-[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]propanoate
CID 83982822
3-(chloromethyl)-1-[(4-methoxyphenyl)methyl]pyrrolidine
CID 63388374
4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]benzonitrile
CID 86311190
1-[3-(hydroxymethyl)piperidin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 3298248
[1-[(4-methoxyphenyl)methyl]piperidin-3-yl] acetate
CID 46898261
methyl 1-[(4-methoxyphenyl)methyl]piperidine-3-carboxylate;hydrochloride
CID 14181476
2-bromo-4-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]-6-methoxyphenol
CID 30842642

Frequently Asked Questions

What is the IUPAC name of [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol?
The IUPAC name of [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol (CID 54793850) is [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol is COc1ccc(CN2CCCC(CO)C2)cc1.
What is the InChIKey of [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol?
The InChIKey is ALIYBBDZXFIALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-17-14-6-4-12(5-7-14)9-15-8-2-3-13(10-15)11-16/h4-7,13,16H,2-3,8-11H2,1H3.
What are the key properties of [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol?
[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanol is sourced from PubChem (CID 54793850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).