[3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol

C19H23NO2 — CID 68777108

IUPAC[3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol
SMILESOCc1cccc(Oc2cccc(CN3CCCCC3)c2)c1
InChIInChI=1S/C19H23NO2/c21-15-17-7-5-9-19(13-17)22-18-8-4-6-16(12-18)14-20-10-2-1-3-11-20/h4-9,12-13,21H,1-3,10-11,14-15H2
InChIKeyWEXUCTWVEMBFPG-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.96
Rot. Bonds5

About [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol

[3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol (PubChem CID 68777108) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol
PubChem CID68777108
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name[3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol
SMILESOCc1cccc(Oc2cccc(CN3CCCCC3)c2)c1
InChIInChI=1S/C19H23NO2/c21-15-17-7-5-9-19(13-17)22-18-8-4-6-16(12-18)14-20-10-2-1-3-11-20/h4-9,12-13,21H,1-3,10-11,14-15H2
InChIKeyWEXUCTWVEMBFPG-UHFFFAOYSA-N
XLogP3.96
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]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

1-[[3-(4-methylphenoxy)phenyl]methyl]pyrrolidine
CID 90725774
1-benzyl-4-[(3-phenoxyphenyl)methyl]piperazine
CID 1376909
(2S)-3-[3-(piperidin-1-ylmethyl)phenoxy]propane-1,2-diol
CID 70943120
N-[4-[3-(pyrrolidin-1-ylmethyl)phenoxy]phenyl]acetamide
CID 56716664
(2R)-1-[3-(piperidin-1-ylmethyl)phenoxy]propan-2-ol
CID 143915546
3-[3-(azepan-1-ylmethyl)phenoxy]propan-1-amine
CID 14625124
1-[(3-methoxyphenyl)methyl]piperidine;phenylmethanamine
CID 174819320
(2R)-1-(azepan-1-yl)-3-[3-(azetidin-1-ylmethyl)phenoxy]propan-2-ol
CID 97274515
azepan-1-yl-[1-[(3-phenoxyphenyl)methyl]piperidin-3-yl]methanone;oxalic acid
CID 90484118
[3-(piperidin-1-ylmethyl)phenyl] N,N-diethylcarbamate
CID 10924256
[3-(piperazin-1-ylmethyl)phenyl]methanol
CID 23023149
2-phenoxy-1-[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]ethanone
CID 2878469

Frequently Asked Questions

What is the IUPAC name of [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol?
The IUPAC name of [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol (CID 68777108) is [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol.
What is the SMILES notation for [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol?
The canonical SMILES for [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol is OCc1cccc(Oc2cccc(CN3CCCCC3)c2)c1.
What is the InChIKey of [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol?
The InChIKey is WEXUCTWVEMBFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c21-15-17-7-5-9-19(13-17)22-18-8-4-6-16(12-18)14-20-10-2-1-3-11-20/h4-9,12-13,21H,1-3,10-11,14-15H2.
What are the key properties of [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol?
[3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol has a molecular weight of 297.40 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(piperidin-1-ylmethyl)phenoxy]phenyl]methanol is sourced from PubChem (CID 68777108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).