3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol

C14H21NO2 — CID 105496580

IUPAC3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol
SMILESCC(O)(CC1CCNCC1)c1cccc(O)c1
InChIInChI=1S/C14H21NO2/c1-14(17,10-11-5-7-15-8-6-11)12-3-2-4-13(16)9-12/h2-4,9,11,15-17H,5-8,10H2,1H3
InChIKeySJTPWQGZNVCLPW-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.99
Rot. Bonds3

About 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol

3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol (PubChem CID 105496580) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol.

Molecular Properties

Compound Name3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol
PubChem CID105496580
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol
SMILESCC(O)(CC1CCNCC1)c1cccc(O)c1
InChIInChI=1S/C14H21NO2/c1-14(17,10-11-5-7-15-8-6-11)12-3-2-4-13(16)9-12/h2-4,9,11,15-17H,5-8,10H2,1H3
InChIKeySJTPWQGZNVCLPW-UHFFFAOYSA-N
XLogP1.99
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol 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

piperidin-4-ylmethyl (2S)-2-hydroxy-2-(3-hydroxyphenyl)-2-phenylacetate;sulfane;hydrochloride
CID 157100174
3-(2-hydroxyhexan-2-yl)phenol
CID 21280529
1-cyclopropyl-2-[3-(2-methylpropyl)phenyl]propan-2-ol
CID 116542889
4-[2-hydroxy-1-(oxan-4-yl)propan-2-yl]phenol
CID 83075141
4-hydroxy-4-(3-hydroxyphenyl)pentanoic acid
CID 66323839
3-(2-fluoro-1-pyrrolidin-2-ylpropan-2-yl)phenol
CID 105480753
2-hydroxy-2,2-diphenyl-N-(piperidin-4-ylmethyl)acetamide
CID 10403987
3-[azepan-4-yl(difluoro)methyl]phenol
CID 84728175
3-(piperidin-4-ylmethylsulfinyl)phenol
CID 84701440
3-(azepan-4-ylmethyl)phenol
CID 83261812
3-[1,1-bis(3-hydroxyphenyl)ethyl]phenol
CID 20564680
2-(4-tert-butylphenyl)-1-cyclobutylpropan-2-ol
CID 113490168

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol?
The IUPAC name of 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol (CID 105496580) is 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol.
What is the SMILES notation for 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol?
The canonical SMILES for 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol is CC(O)(CC1CCNCC1)c1cccc(O)c1.
What is the InChIKey of 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol?
The InChIKey is SJTPWQGZNVCLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-14(17,10-11-5-7-15-8-6-11)12-3-2-4-13(16)9-12/h2-4,9,11,15-17H,5-8,10H2,1H3.
What are the key properties of 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol?
3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol has a molecular weight of 235.33 g/mol, XLogP of 1.99, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxy-1-piperidin-4-ylpropan-2-yl)phenol is sourced from PubChem (CID 105496580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).