3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one

C16H23NO3 — CID 82691756

IUPAC3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one
SMILESO=C(CCN1CCC(OCCO)CC1)c1ccccc1
InChIInChI=1S/C16H23NO3/c18-12-13-20-15-6-9-17(10-7-15)11-8-16(19)14-4-2-1-3-5-14/h1-5,15,18H,6-13H2
InChIKeyJASKRJQRXFBDNL-UHFFFAOYSA-N
MW277.36 g/mol
LogP1.73
Rot. Bonds7

About 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one

3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one (PubChem CID 82691756) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one.

Molecular Properties

Compound Name3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one
PubChem CID82691756
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one
SMILESO=C(CCN1CCC(OCCO)CC1)c1ccccc1
InChIInChI=1S/C16H23NO3/c18-12-13-20-15-6-9-17(10-7-15)11-8-16(19)14-4-2-1-3-5-14/h1-5,15,18H,6-13H2
InChIKeyJASKRJQRXFBDNL-UHFFFAOYSA-N
XLogP1.73
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one 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

3-(4-tert-butylpiperidin-1-yl)-1-phenylpropan-1-one
CID 62614079
3-[4-(2-methoxyethyl)piperazin-1-yl]-1-phenylpropan-1-one
CID 118909812
3-[3-(hydroxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-one
CID 112571405
3-(4-methylazepan-1-yl)-1-phenylpropan-1-one
CID 55249403
1-phenyl-3-(4-propylpiperidin-1-yl)propan-1-one
CID 62614251
2-[1-(3-oxo-3-phenylpropyl)piperidin-4-yl]acetamide
CID 115926022
2-[4-(2-hydroxyethoxy)piperidin-1-yl]ethanol
CID 115771078
1-(4-bromophenyl)-3-(4-ethoxypiperidin-1-yl)propan-1-one
CID 62612812
2-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-(2-methylphenyl)ethanone
CID 82691118
3-(4-methylpiperazin-1-yl)-1-phenylpropan-1-one chloride
CID 21231581
1-phenyl-3-piperidin-4-yloxypropan-1-one
CID 116572261
3-(4-cyclohexylpiperazin-1-yl)-1-phenylpropan-1-one
CID 166604154

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one?
The IUPAC name of 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one (CID 82691756) is 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one.
What is the SMILES notation for 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one?
The canonical SMILES for 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one is O=C(CCN1CCC(OCCO)CC1)c1ccccc1.
What is the InChIKey of 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one?
The InChIKey is JASKRJQRXFBDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c18-12-13-20-15-6-9-17(10-7-15)11-8-16(19)14-4-2-1-3-5-14/h1-5,15,18H,6-13H2.
What are the key properties of 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one?
3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one has a molecular weight of 277.36 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-hydroxyethoxy)piperidin-1-yl]-1-phenylpropan-1-one is sourced from PubChem (CID 82691756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).