2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol

C15H31NO — CID 55064618

IUPAC2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol
SMILESCCCCC(CC)CN1CCCC(CCO)C1
InChIInChI=1S/C15H31NO/c1-3-5-7-14(4-2)12-16-10-6-8-15(13-16)9-11-17/h14-15,17H,3-13H2,1-2H3
InChIKeyGYYJVMQLIIQPIS-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.30
Rot. Bonds8

About 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol

2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol (PubChem CID 55064618) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol
PubChem CID55064618
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol
SMILESCCCCC(CC)CN1CCCC(CCO)C1
InChIInChI=1S/C15H31NO/c1-3-5-7-14(4-2)12-16-10-6-8-15(13-16)9-11-17/h14-15,17H,3-13H2,1-2H3
InChIKeyGYYJVMQLIIQPIS-UHFFFAOYSA-N
XLogP3.30
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-ethylhexyl)pyrrolidin-3-yl]ethanol
CID 104627914
2-[1-(2-ethylbutyl)pyrrolidin-3-yl]ethanol
CID 115875415
[1-(2-ethylbutyl)piperidin-3-yl]methanol
CID 82931010
2-(1-propylpiperidin-3-yl)ethanol
CID 22987971
1-[1-(2-ethylhexyl)piperidin-3-yl]ethanamine
CID 55258928
2-ethyl-1-[3-(2-hydroxyethyl)piperidin-1-yl]hexan-1-one
CID 62372858
1-(2-ethylhexyl)-3-methyl-1,4-diazepane
CID 64859197
1-(2-ethylhexyl)pyrrolidine-3,4-diol
CID 106672045
[1-(2-ethylhexyl)piperidin-2-yl]methanol
CID 62021752
4-bromo-1-(2-ethylhexyl)piperidine
CID 80678889
2-ethyl-2-[[3-(2-hydroxyethyl)piperidin-1-yl]methyl]butan-1-ol
CID 107229026
3-[(3-propylazetidin-1-yl)methyl]pentan-1-ol
CID 104550573

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol?
The IUPAC name of 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol (CID 55064618) is 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol is CCCCC(CC)CN1CCCC(CCO)C1.
What is the InChIKey of 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol?
The InChIKey is GYYJVMQLIIQPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-3-5-7-14(4-2)12-16-10-6-8-15(13-16)9-11-17/h14-15,17H,3-13H2,1-2H3.
What are the key properties of 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol?
2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol has a molecular weight of 241.42 g/mol, XLogP of 3.30, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-ethylhexyl)piperidin-3-yl]ethanol is sourced from PubChem (CID 55064618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).