2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol

C9H20N2O2 — CID 67061284

IUPAC2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol
SMILESOCCNC1CCN(CCO)CC1
InChIInChI=1S/C9H20N2O2/c12-7-3-10-9-1-4-11(5-2-9)6-8-13/h9-10,12-13H,1-8H2
InChIKeyBTBKNTQXGAFTLI-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.98
Rot. Bonds5

About 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol

2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol (PubChem CID 67061284) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol
PubChem CID67061284
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol
SMILESOCCNC1CCN(CCO)CC1
InChIInChI=1S/C9H20N2O2/c12-7-3-10-9-1-4-11(5-2-9)6-8-13/h9-10,12-13H,1-8H2
InChIKeyBTBKNTQXGAFTLI-UHFFFAOYSA-N
XLogP-0.98
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol?
The IUPAC name of 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol (CID 67061284) is 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol.
What is the SMILES notation for 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol?
The canonical SMILES for 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol is OCCNC1CCN(CCO)CC1.
What is the InChIKey of 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol?
The InChIKey is BTBKNTQXGAFTLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c12-7-3-10-9-1-4-11(5-2-9)6-8-13/h9-10,12-13H,1-8H2.
What are the key properties of 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol?
2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol has a molecular weight of 188.27 g/mol, XLogP of -0.98, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-hydroxyethyl)piperidin-4-yl]amino]ethanol is sourced from PubChem (CID 67061284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).