2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol

C11H24N2O2 — CID 81460608

IUPAC2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol
SMILESCCC1CN(CCOCCO)CCC1N
InChIInChI=1S/C11H24N2O2/c1-2-10-9-13(4-3-11(10)12)5-7-15-8-6-14/h10-11,14H,2-9,12H2,1H3
InChIKeyOXWQLIBHIGSBHV-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.05
Rot. Bonds6

About 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol

2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol (PubChem CID 81460608) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol
PubChem CID81460608
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol
SMILESCCC1CN(CCOCCO)CCC1N
InChIInChI=1S/C11H24N2O2/c1-2-10-9-13(4-3-11(10)12)5-7-15-8-6-14/h10-11,14H,2-9,12H2,1H3
InChIKeyOXWQLIBHIGSBHV-UHFFFAOYSA-N
XLogP0.05
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol?
The IUPAC name of 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol (CID 81460608) is 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol?
The canonical SMILES for 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol is CCC1CN(CCOCCO)CCC1N.
What is the InChIKey of 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol?
The InChIKey is OXWQLIBHIGSBHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-2-10-9-13(4-3-11(10)12)5-7-15-8-6-14/h10-11,14H,2-9,12H2,1H3.
What are the key properties of 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol?
2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol has a molecular weight of 216.32 g/mol, XLogP of 0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol is sourced from PubChem (CID 81460608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).