2-amino-2-(5-chlorofuran-2-yl)ethanol

C6H8ClNO2 — CID 55295388

IUPAC2-amino-2-(5-chlorofuran-2-yl)ethanol
SMILESNC(CO)c1ccc(Cl)o1
InChIInChI=1S/C6H8ClNO2/c7-6-2-1-5(10-6)4(8)3-9/h1-2,4,9H,3,8H2
InChIKeyDPFXUPJWVJGZHB-UHFFFAOYSA-N
MW161.59 g/mol
LogP0.93
Rot. Bonds2

About 2-amino-2-(5-chlorofuran-2-yl)ethanol

2-amino-2-(5-chlorofuran-2-yl)ethanol (PubChem CID 55295388) has the molecular formula C6H8ClNO2 and a molecular weight of 161.59 g/mol. Its IUPAC name is 2-amino-2-(5-chlorofuran-2-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(5-chlorofuran-2-yl)ethanol
PubChem CID55295388
Molecular FormulaC6H8ClNO2
Molecular Weight161.59 g/mol
Exact Mass161.02
IUPAC Name2-amino-2-(5-chlorofuran-2-yl)ethanol
SMILESNC(CO)c1ccc(Cl)o1
InChIInChI=1S/C6H8ClNO2/c7-6-2-1-5(10-6)4(8)3-9/h1-2,4,9H,3,8H2
InChIKeyDPFXUPJWVJGZHB-UHFFFAOYSA-N
XLogP0.93
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.59
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(5-chlorofuran-2-yl)propan-1-amine
CID 131197963
1-(5-chlorofuran-2-yl)-3-methylbut-3-en-1-amine
CID 106692476
1-(5-chlorofuran-2-yl)butan-1-amine
CID 55295199
2-amino-2-(5-bromofuran-2-yl)ethanol
CID 82659275
(3S)-3-amino-3-(5-chlorofuran-2-yl)propanenitrile
CID 130956865
(1S)-1-(5-chlorofuran-2-yl)-3,3-difluoropropan-1-amine;hydrochloride
CID 171313296
(1S)-1-(5-chlorofuran-2-yl)-2-cyclopropylethanamine
CID 55272415
ethyl (3S)-3-amino-3-(5-chlorofuran-2-yl)propanoate
CID 171233148
1-(5-chlorofuran-2-yl)-2-(4-iodophenyl)ethanamine
CID 106692144
(1R)-2-amino-1-(5-chlorofuran-2-yl)ethanol
CID 96633937
1-amino-1-(5-chlorofuran-2-yl)butan-2-ol
CID 130143451
1-(5-chlorofuran-2-yl)-2-(3-chlorophenyl)ethanamine
CID 106687882

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(5-chlorofuran-2-yl)ethanol?
The IUPAC name of 2-amino-2-(5-chlorofuran-2-yl)ethanol (CID 55295388) is 2-amino-2-(5-chlorofuran-2-yl)ethanol.
What is the SMILES notation for 2-amino-2-(5-chlorofuran-2-yl)ethanol?
The canonical SMILES for 2-amino-2-(5-chlorofuran-2-yl)ethanol is NC(CO)c1ccc(Cl)o1.
What is the InChIKey of 2-amino-2-(5-chlorofuran-2-yl)ethanol?
The InChIKey is DPFXUPJWVJGZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClNO2/c7-6-2-1-5(10-6)4(8)3-9/h1-2,4,9H,3,8H2.
What are the key properties of 2-amino-2-(5-chlorofuran-2-yl)ethanol?
2-amino-2-(5-chlorofuran-2-yl)ethanol has a molecular weight of 161.59 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(5-chlorofuran-2-yl)ethanol is sourced from PubChem (CID 55295388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).