2-amino-2-(furan-2-yl)ethanol

C6H9NO2 — CID 54048773

IUPAC2-amino-2-(furan-2-yl)ethanol
SMILESNC(CO)c1ccco1
InChIInChI=1S/C6H9NO2/c7-5(4-8)6-2-1-3-9-6/h1-3,5,8H,4,7H2
InChIKeyLRKBGEPUMHLXRV-UHFFFAOYSA-N
MW127.14 g/mol
LogP0.27
Rot. Bonds2

About 2-amino-2-(furan-2-yl)ethanol

2-amino-2-(furan-2-yl)ethanol (PubChem CID 54048773) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is 2-amino-2-(furan-2-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(furan-2-yl)ethanol
PubChem CID54048773
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC Name2-amino-2-(furan-2-yl)ethanol
SMILESNC(CO)c1ccco1
InChIInChI=1S/C6H9NO2/c7-5(4-8)6-2-1-3-9-6/h1-3,5,8H,4,7H2
InChIKeyLRKBGEPUMHLXRV-UHFFFAOYSA-N
XLogP0.27
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-4-amino-4-(furan-2-yl)butan-1-ol
CID 131230101
(4S)-4-amino-4-(furan-2-yl)butan-1-ol;hydrochloride
CID 171231726
(1S)-1-(furan-2-yl)propan-1-amine;hydrochloride
CID 11615221
(3R)-3-amino-3-(furan-2-yl)propanoic acid;hydrochloride
CID 155903198
3-amino-3-(furan-2-yl)propanoyl iodide
CID 163471239
(1S)-1-(furan-2-yl)-3-methylbut-3-en-1-amine
CID 131000468
1-(furan-2-yl)butan-1-amine;hydrochloride
CID 86262899
1-(furan-2-yl)-3-methylbutan-1-amine;hydrochloride
CID 86263007
(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol
CID 66514043
3-amino-3-(furan-2-yl)-2,2-dimethylpropan-1-ol
CID 130059387
1-(furan-2-yl)-3,3-dimethylbutan-1-amine;hydrochloride
CID 86263034
(3S)-3-amino-2,2-difluoro-3-(furan-2-yl)propan-1-ol
CID 130700545

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(furan-2-yl)ethanol?
The IUPAC name of 2-amino-2-(furan-2-yl)ethanol (CID 54048773) is 2-amino-2-(furan-2-yl)ethanol.
What is the SMILES notation for 2-amino-2-(furan-2-yl)ethanol?
The canonical SMILES for 2-amino-2-(furan-2-yl)ethanol is NC(CO)c1ccco1.
What is the InChIKey of 2-amino-2-(furan-2-yl)ethanol?
The InChIKey is LRKBGEPUMHLXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2/c7-5(4-8)6-2-1-3-9-6/h1-3,5,8H,4,7H2.
What are the key properties of 2-amino-2-(furan-2-yl)ethanol?
2-amino-2-(furan-2-yl)ethanol has a molecular weight of 127.14 g/mol, XLogP of 0.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(furan-2-yl)ethanol is sourced from PubChem (CID 54048773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).