2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol

C18H24FN3O2 — CID 51104597

IUPAC2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol
SMILESOCCn1nccc1C1CCN(CCOc2ccccc2F)CC1
InChIInChI=1S/C18H24FN3O2/c19-16-3-1-2-4-18(16)24-14-12-21-9-6-15(7-10-21)17-5-8-20-22(17)11-13-23/h1-5,8,15,23H,6-7,9-14H2
InChIKeyDFCGFSCCBQXVAS-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.27
Rot. Bonds7

About 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol

2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol (PubChem CID 51104597) has the molecular formula C18H24FN3O2 and a molecular weight of 333.41 g/mol. Its IUPAC name is 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol
PubChem CID51104597
Molecular FormulaC18H24FN3O2
Molecular Weight333.41 g/mol
Exact Mass333.19
IUPAC Name2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol
SMILESOCCn1nccc1C1CCN(CCOc2ccccc2F)CC1
InChIInChI=1S/C18H24FN3O2/c19-16-3-1-2-4-18(16)24-14-12-21-9-6-15(7-10-21)17-5-8-20-22(17)11-13-23/h1-5,8,15,23H,6-7,9-14H2
InChIKeyDFCGFSCCBQXVAS-UHFFFAOYSA-N
XLogP2.27
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol 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

2-(3-{2-[(4-fluorobenzyl)oxy]phenyl}-1H-pyrazol-1-yl)-1-ethanol
CID 1485523
2-[4-(2,6-Difluorophenoxy)-3,5-diethyl-pyrazol-1-yl]ethanol
CID 9900810
2-[4-(2,5-Difluorophenoxy)-3,5-diethyl-pyrazol-1-yl]ethanol
CID 9922209
2-[4-(3,5-Difluorophenoxy)-3,5-diethyl-pyrazol-1-yl]ethanol
CID 9922210
{4-(2-phenoxyethyl)-1-[3-(1H-pyrazol-1-yl)propyl]-4-piperidinyl}methanol
CID 16187212
(1-{[1-methyl-3-(4-phenoxyphenyl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)methanol
CID 16187569
1-(1-{[3-(3-fluorophenyl)-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-4-piperidinyl)-1-propanol
CID 16190220
{4-(4-methoxybenzyl)-1-[(5-methyl-1-propyl-1H-pyrazol-4-yl)methyl]piperidin-4-yl}methanol
CID 16190591
1-(4-{[[(1,3-dimethyl-1H-pyrazol-4-yl)methyl](methyl)amino]methyl}phenoxy)-3-(1-piperidinyl)-2-propanol
CID 16191452
2-{1-(4-ethoxybenzyl)-4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-2-piperazinyl}ethanol
CID 16192019
2-{1-(4-ethoxybenzyl)-4-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-piperazinyl}ethanol
CID 16192129
2-[{[3-(3-fluorophenyl)-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}(methyl)amino]ethanol
CID 16192378

Frequently Asked Questions

What is the IUPAC name of 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol (CID 51104597) is 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol is OCCn1nccc1C1CCN(CCOc2ccccc2F)CC1.
What is the InChIKey of 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
The InChIKey is DFCGFSCCBQXVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN3O2/c19-16-3-1-2-4-18(16)24-14-12-21-9-6-15(7-10-21)17-5-8-20-22(17)11-13-23/h1-5,8,15,23H,6-7,9-14H2.
What are the key properties of 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol has a molecular weight of 333.41 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 51104597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).