2-(1-aminopropan-2-yloxy)ethanol;hydrochloride

C5H14ClNO2 — CID 86645498

IUPAC2-(1-aminopropan-2-yloxy)ethanol;hydrochloride
SMILESCC(CN)OCCO.Cl
InChIInChI=1S/C5H13NO2.ClH/c1-5(4-6)8-3-2-7;/h5,7H,2-4,6H2,1H3;1H
InChIKeyCUEQYVHESSFNKP-UHFFFAOYSA-N
MW155.62 g/mol
LogP-0.24
Rot. Bonds4

About 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride

2-(1-aminopropan-2-yloxy)ethanol;hydrochloride (PubChem CID 86645498) has the molecular formula C5H14ClNO2 and a molecular weight of 155.62 g/mol. Its IUPAC name is 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride.

Molecular Properties

Compound Name2-(1-aminopropan-2-yloxy)ethanol;hydrochloride
PubChem CID86645498
Molecular FormulaC5H14ClNO2
Molecular Weight155.62 g/mol
Exact Mass155.07
IUPAC Name2-(1-aminopropan-2-yloxy)ethanol;hydrochloride
SMILESCC(CN)OCCO.Cl
InChIInChI=1S/C5H13NO2.ClH/c1-5(4-6)8-3-2-7;/h5,7H,2-4,6H2,1H3;1H
InChIKeyCUEQYVHESSFNKP-UHFFFAOYSA-N
XLogP-0.24
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.62
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride?
The IUPAC name of 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride (CID 86645498) is 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride.
What is the SMILES notation for 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride?
The canonical SMILES for 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride is CC(CN)OCCO.Cl.
What is the InChIKey of 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride?
The InChIKey is CUEQYVHESSFNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2.ClH/c1-5(4-6)8-3-2-7;/h5,7H,2-4,6H2,1H3;1H.
What are the key properties of 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride?
2-(1-aminopropan-2-yloxy)ethanol;hydrochloride has a molecular weight of 155.62 g/mol, XLogP of -0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminopropan-2-yloxy)ethanol;hydrochloride is sourced from PubChem (CID 86645498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).