2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine

C17H37N5O2 — CID 174426773

IUPAC2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine
SMILESC1CNCCN1.OCCC1CCCCN1C1CNCCN1CCO
InChIInChI=1S/C13H27N3O2.C4H10N2/c17-9-4-12-3-1-2-6-16(12)13-11-14-5-7-15(13)8-10-18;1-2-6-4-3-5-1/h12-14,17-18H,1-11H2;5-6H,1-4H2
InChIKeyLNTQSTYPIOEZMA-UHFFFAOYSA-N
MW343.52 g/mol
LogP-1.37
Rot. Bonds5

About 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine

2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine (PubChem CID 174426773) has the molecular formula C17H37N5O2 and a molecular weight of 343.52 g/mol. Its IUPAC name is 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine.

Molecular Properties

Compound Name2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine
PubChem CID174426773
Molecular FormulaC17H37N5O2
Molecular Weight343.52 g/mol
Exact Mass343.29
IUPAC Name2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine
SMILESC1CNCCN1.OCCC1CCCCN1C1CNCCN1CCO
InChIInChI=1S/C13H27N3O2.C4H10N2/c17-9-4-12-3-1-2-6-16(12)13-11-14-5-7-15(13)8-10-18;1-2-6-4-3-5-1/h12-14,17-18H,1-11H2;5-6H,1-4H2
InChIKeyLNTQSTYPIOEZMA-UHFFFAOYSA-N
XLogP-1.37
TPSA83.03 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.52
LogP ≤ 5-1.37
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

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Related Compounds

2-[1-(azepan-4-yl)piperidin-2-yl]ethanol
CID 103983135
2-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-4-yl)ethanol
CID 75576493
2-[1-[4-[[cyclohexyl(methyl)amino]methyl]piperidin-3-yl]piperidin-2-yl]ethanol
CID 82565142
2-[1-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-3-yl]piperidin-2-yl]ethanol
CID 82565137
2-[(5S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol
CID 130941698
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
2-[1-[2-(hydroxymethyl)piperidin-1-yl]piperidin-2-yl]ethanol
CID 57022132
2-[1-[[3-(dimethylamino)piperidin-4-yl]methyl]piperidin-2-yl]ethanol
CID 82564786
2-[1-(2-hydroxysulfonothioylethyl)piperazin-2-yl]ethanol
CID 166513972
2-(1-iodopiperazin-2-yl)ethanol
CID 126690105
4-[2-(2-hydroxyethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 79361314
2-[2-(1-chloropropyl)piperazin-1-yl]ethanol
CID 141484179

Frequently Asked Questions

What is the IUPAC name of 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine?
The IUPAC name of 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine (CID 174426773) is 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine.
What is the SMILES notation for 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine?
The canonical SMILES for 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine is C1CNCCN1.OCCC1CCCCN1C1CNCCN1CCO.
What is the InChIKey of 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine?
The InChIKey is LNTQSTYPIOEZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2.C4H10N2/c17-9-4-12-3-1-2-6-16(12)13-11-14-5-7-15(13)8-10-18;1-2-6-4-3-5-1/h12-14,17-18H,1-11H2;5-6H,1-4H2.
What are the key properties of 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine?
2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine has a molecular weight of 343.52 g/mol, XLogP of -1.37, 5 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine is sourced from PubChem (CID 174426773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).