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

C10H22N2O2 — CID 4711813

IUPAC2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol
SMILESCN1CCC(NCCOCCO)CC1
InChIInChI=1S/C10H22N2O2/c1-12-5-2-10(3-6-12)11-4-8-14-9-7-13/h10-11,13H,2-9H2,1H3
InChIKeyZLUQDVBYWVDIQM-UHFFFAOYSA-N
MW202.30 g/mol
LogP-0.32
Rot. Bonds6

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

2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol (PubChem CID 4711813) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol
PubChem CID4711813
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol
SMILESCN1CCC(NCCOCCO)CC1
InChIInChI=1S/C10H22N2O2/c1-12-5-2-10(3-6-12)11-4-8-14-9-7-13/h10-11,13H,2-9H2,1H3
InChIKeyZLUQDVBYWVDIQM-UHFFFAOYSA-N
XLogP-0.32
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 5-0.32
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-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol?
The IUPAC name of 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol (CID 4711813) is 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol?
The canonical SMILES for 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol is CN1CCC(NCCOCCO)CC1.
What is the InChIKey of 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol?
The InChIKey is ZLUQDVBYWVDIQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-12-5-2-10(3-6-12)11-4-8-14-9-7-13/h10-11,13H,2-9H2,1H3.
What are the key properties of 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol?
2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol has a molecular weight of 202.30 g/mol, XLogP of -0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1-methylpiperidin-4-yl)amino]ethoxy]ethanol is sourced from PubChem (CID 4711813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).