2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol

C15H22ClNO2 — CID 60690193

IUPAC2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol
SMILESOCCC1CCCCN1CCOc1ccccc1Cl
InChIInChI=1S/C15H22ClNO2/c16-14-6-1-2-7-15(14)19-12-10-17-9-4-3-5-13(17)8-11-18/h1-2,6-7,13,18H,3-5,8-12H2
InChIKeyGREACQJAOJXZRL-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.96
Rot. Bonds6

About 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol

2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol (PubChem CID 60690193) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol
PubChem CID60690193
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol
SMILESOCCC1CCCCN1CCOc1ccccc1Cl
InChIInChI=1S/C15H22ClNO2/c16-14-6-1-2-7-15(14)19-12-10-17-9-4-3-5-13(17)8-11-18/h1-2,6-7,13,18H,3-5,8-12H2
InChIKeyGREACQJAOJXZRL-UHFFFAOYSA-N
XLogP2.96
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[2-(2,4-dichlorophenoxy)ethyl]piperidin-2-yl]ethanol
CID 60690332
2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol
CID 60690162
1-[2-[2-[2-(2-hydroxyethyl)piperidin-1-yl]ethoxy]phenyl]ethanone
CID 60690046
3-[1-[2-(2-methylphenoxy)ethyl]pyrrolidin-2-yl]propan-1-ol
CID 62467802
2-[1-[3-(4-chlorophenoxy)propyl]piperidin-2-yl]ethanol
CID 60690500
2-[2-[2-(hydroxymethyl)azepan-1-yl]ethoxy]benzonitrile
CID 116634750
[(2S)-1-[2-(2-fluorophenoxy)ethyl]pyrrolidin-2-yl]methanol
CID 78942355
3-[1-[3-(2-aminophenoxy)propyl]pyrrolidin-2-yl]propan-1-ol
CID 62466981
1-[3-(2-chlorophenoxy)propyl]piperidine-2-carboxylic acid
CID 82224108
2-[1-[2-chloro-2-(2-methoxyphenyl)ethyl]piperidin-2-yl]ethanol
CID 82215107
1-[2-(2-chlorophenoxy)ethyl]-3-methylpiperidine-2-carboxylic acid
CID 107072550
2-[2-(2-chlorophenoxy)ethyl-cyclopentylamino]ethanol
CID 62014085

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol (CID 60690193) is 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol is OCCC1CCCCN1CCOc1ccccc1Cl.
What is the InChIKey of 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol?
The InChIKey is GREACQJAOJXZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c16-14-6-1-2-7-15(14)19-12-10-17-9-4-3-5-13(17)8-11-18/h1-2,6-7,13,18H,3-5,8-12H2.
What are the key properties of 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol?
2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol has a molecular weight of 283.80 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 60690193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).