2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone

C16H23NO2 — CID 62035423

IUPAC2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone
SMILESCCCc1ccc(C(=O)CN2CCCC(O)C2)cc1
InChIInChI=1S/C16H23NO2/c1-2-4-13-6-8-14(9-7-13)16(19)12-17-10-3-5-15(18)11-17/h6-9,15,18H,2-5,10-12H2,1H3
InChIKeyGIUKVYOHKSTEGT-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.28
Rot. Bonds5

About 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone

2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone (PubChem CID 62035423) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone.

Molecular Properties

Compound Name2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone
PubChem CID62035423
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC Name2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone
SMILESCCCc1ccc(C(=O)CN2CCCC(O)C2)cc1
InChIInChI=1S/C16H23NO2/c1-2-4-13-6-8-14(9-7-13)16(19)12-17-10-3-5-15(18)11-17/h6-9,15,18H,2-5,10-12H2,1H3
InChIKeyGIUKVYOHKSTEGT-UHFFFAOYSA-N
XLogP2.28
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone 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-(4-propylphenyl)-2-pyrrolidin-1-ylethanone
CID 43219358
2-(3-ethyl-4-methylpiperazin-1-yl)-1-(4-propylphenyl)ethanone
CID 63633398
2-(3-aminopiperidin-1-yl)-1-(4-ethylphenyl)ethanone
CID 62036122
1-(4-propylphenyl)-2-(1,4-thiazepan-4-yl)ethanone
CID 62030887
2-morpholin-4-yl-1-(4-propylphenyl)ethanone
CID 43219458
2-(2,6-dimethylpiperidin-1-yl)-1-(4-propylphenyl)ethanone
CID 43219533
2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(4-propylphenyl)ethanone
CID 62024063
2-(3-hydroxypyrrolidin-1-yl)-1-(4-iodophenyl)ethanone
CID 62941898
1-(3-bromo-4-methoxyphenyl)-2-(3-hydroxypiperidin-1-yl)ethanone
CID 60680649
2-(3-hydroxypiperidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 56829037
3-piperidin-1-yl-1-(4-propylphenyl)propan-1-one
CID 94273024
1-(4-ethylphenyl)-2-pyrrolidin-1-ylethanone
CID 43219356

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone?
The IUPAC name of 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone (CID 62035423) is 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone.
What is the SMILES notation for 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone?
The canonical SMILES for 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone is CCCc1ccc(C(=O)CN2CCCC(O)C2)cc1.
What is the InChIKey of 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone?
The InChIKey is GIUKVYOHKSTEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-2-4-13-6-8-14(9-7-13)16(19)12-17-10-3-5-15(18)11-17/h6-9,15,18H,2-5,10-12H2,1H3.
What are the key properties of 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone?
2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone has a molecular weight of 261.37 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypiperidin-1-yl)-1-(4-propylphenyl)ethanone is sourced from PubChem (CID 62035423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).