2-amino-1-(furan-3-yl)ethanol;hydrochloride

C6H10ClNO2 — CID 55266338

IUPAC2-amino-1-(furan-3-yl)ethanol;hydrochloride
SMILESCl.NCC(O)c1ccoc1
InChIInChI=1S/C6H9NO2.ClH/c7-3-6(8)5-1-2-9-4-5;/h1-2,4,6,8H,3,7H2;1H
InChIKeyWOTQHRHYSRURMQ-UHFFFAOYSA-N
MW163.60 g/mol
LogP0.69
Rot. Bonds2

About 2-amino-1-(furan-3-yl)ethanol;hydrochloride

2-amino-1-(furan-3-yl)ethanol;hydrochloride (PubChem CID 55266338) has the molecular formula C6H10ClNO2 and a molecular weight of 163.60 g/mol. Its IUPAC name is 2-amino-1-(furan-3-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(furan-3-yl)ethanol;hydrochloride
PubChem CID55266338
Molecular FormulaC6H10ClNO2
Molecular Weight163.60 g/mol
Exact Mass163.04
IUPAC Name2-amino-1-(furan-3-yl)ethanol;hydrochloride
SMILESCl.NCC(O)c1ccoc1
InChIInChI=1S/C6H9NO2.ClH/c7-3-6(8)5-1-2-9-4-5;/h1-2,4,6,8H,3,7H2;1H
InChIKeyWOTQHRHYSRURMQ-UHFFFAOYSA-N
XLogP0.69
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.60
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(furan-3-yl)ethanol;hydrochloride?
The IUPAC name of 2-amino-1-(furan-3-yl)ethanol;hydrochloride (CID 55266338) is 2-amino-1-(furan-3-yl)ethanol;hydrochloride.
What is the SMILES notation for 2-amino-1-(furan-3-yl)ethanol;hydrochloride?
The canonical SMILES for 2-amino-1-(furan-3-yl)ethanol;hydrochloride is Cl.NCC(O)c1ccoc1.
What is the InChIKey of 2-amino-1-(furan-3-yl)ethanol;hydrochloride?
The InChIKey is WOTQHRHYSRURMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2.ClH/c7-3-6(8)5-1-2-9-4-5;/h1-2,4,6,8H,3,7H2;1H.
What are the key properties of 2-amino-1-(furan-3-yl)ethanol;hydrochloride?
2-amino-1-(furan-3-yl)ethanol;hydrochloride has a molecular weight of 163.60 g/mol, XLogP of 0.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(furan-3-yl)ethanol;hydrochloride is sourced from PubChem (CID 55266338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).