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

C16H25NO2 — CID 60690162

IUPAC2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol
SMILESCc1ccccc1OCCN1CCCCC1CCO
InChIInChI=1S/C16H25NO2/c1-14-6-2-3-8-16(14)19-13-11-17-10-5-4-7-15(17)9-12-18/h2-3,6,8,15,18H,4-5,7,9-13H2,1H3
InChIKeyKEOLDEPKQNSVPI-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.61
Rot. Bonds6

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

2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol (PubChem CID 60690162) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol
PubChem CID60690162
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol
SMILESCc1ccccc1OCCN1CCCCC1CCO
InChIInChI=1S/C16H25NO2/c1-14-6-2-3-8-16(14)19-13-11-17-10-5-4-7-15(17)9-12-18/h2-3,6,8,15,18H,4-5,7,9-13H2,1H3
InChIKeyKEOLDEPKQNSVPI-UHFFFAOYSA-N
XLogP2.61
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-[2-(2-methylphenoxy)ethyl]pyrrolidin-2-yl]propan-1-ol
CID 62467802
2-[1-[2-(2-chlorophenoxy)ethyl]piperidin-2-yl]ethanol
CID 60690193
3-[1-[3-(2-methylphenoxy)propyl]pyrrolidin-2-yl]propan-1-ol
CID 111103083
1-[2-[2-[2-(2-hydroxyethyl)piperidin-1-yl]ethoxy]phenyl]ethanone
CID 60690046
1-methyl-2-[2-(2-methylphenoxy)ethyl]pyrrolidine
CID 23339324
1-[2-(2-methylphenoxy)ethyl]piperidine-2-carbaldehyde
CID 62654078
2-[1-[2-(2,4-dichlorophenoxy)ethyl]piperidin-2-yl]ethanol
CID 60690332
3-[2-(2-hydroxyethyl)piperidin-1-yl]-1-(2-methylphenyl)propan-1-ol
CID 62624367
2-methyl-1-[6-(2-methylphenoxy)hexyl]piperidine
CID 16616246
3-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methylphenyl)propanamide
CID 111476136
ethyl 1-[2-(2-methylphenoxy)ethyl]pyrrolidine-2-carboxylate
CID 62028747
2-[2-[2-(hydroxymethyl)azepan-1-yl]ethoxy]benzonitrile
CID 116634750

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol (CID 60690162) is 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol is Cc1ccccc1OCCN1CCCCC1CCO.
What is the InChIKey of 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol?
The InChIKey is KEOLDEPKQNSVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-14-6-2-3-8-16(14)19-13-11-17-10-5-4-7-15(17)9-12-18/h2-3,6,8,15,18H,4-5,7,9-13H2,1H3.
What are the key properties of 2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol?
2-[1-[2-(2-methylphenoxy)ethyl]piperidin-2-yl]ethanol has a molecular weight of 263.38 g/mol, XLogP of 2.61, 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-methylphenoxy)ethyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 60690162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).