2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol

C11H24N2O3 — CID 166715109

IUPAC2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol
SMILESNCCOCCN1CCC(OCCO)CC1
InChIInChI=1S/C11H24N2O3/c12-3-8-15-9-6-13-4-1-11(2-5-13)16-10-7-14/h11,14H,1-10,12H2
InChIKeyUDBRITMJVBGMHT-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.56
Rot. Bonds8

About 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol

2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol (PubChem CID 166715109) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol
PubChem CID166715109
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol
SMILESNCCOCCN1CCC(OCCO)CC1
InChIInChI=1S/C11H24N2O3/c12-3-8-15-9-6-13-4-1-11(2-5-13)16-10-7-14/h11,14H,1-10,12H2
InChIKeyUDBRITMJVBGMHT-UHFFFAOYSA-N
XLogP-0.56
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-(4-ethoxypiperidin-1-yl)ethoxy]ethanamine
CID 79478299
2-[4-(2-hydroxyethoxy)piperidin-1-yl]ethanol
CID 115771078
3-[4-(3-aminopropoxy)piperidin-1-yl]propan-1-ol
CID 79735052
2-[1-(5-sulfanylpentyl)piperidin-4-yl]oxyethanol
CID 82693649
2-[2-(4-methylpiperidin-1-yl)ethoxy]ethanamine
CID 39237896
1-[2-(2-aminoethoxy)ethyl]piperidin-4-amine;ethane
CID 156883236
2-[2-[4-(3-aminopropyl)piperazin-1-yl]ethoxy]ethanol
CID 61070861
2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine
CID 82692525
1-[2-(2-aminoethoxy)ethyl]-N,N-dimethylpiperidin-4-amine
CID 79478502
3-[4-(2-aminoethoxy)piperidin-1-yl]propane-1,2-diol
CID 82843758
2-[1-(3-ethylsulfanylpropyl)piperidin-4-yl]oxyethanol
CID 115771131
3-[4-(2-hydroxyethoxy)piperidin-1-yl]propanimidamide
CID 82696701

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol?
The IUPAC name of 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol (CID 166715109) is 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol.
What is the SMILES notation for 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol?
The canonical SMILES for 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol is NCCOCCN1CCC(OCCO)CC1.
What is the InChIKey of 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol?
The InChIKey is UDBRITMJVBGMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c12-3-8-15-9-6-13-4-1-11(2-5-13)16-10-7-14/h11,14H,1-10,12H2.
What are the key properties of 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol?
2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol has a molecular weight of 232.32 g/mol, XLogP of -0.56, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]oxyethanol is sourced from PubChem (CID 166715109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).