2-amino-1-(5-methylfuran-2-yl)ethanol

C7H11NO2 — CID 16768177

IUPAC2-amino-1-(5-methylfuran-2-yl)ethanol
SMILESCc1ccc(C(O)CN)o1
InChIInChI=1S/C7H11NO2/c1-5-2-3-7(10-5)6(9)4-8/h2-3,6,9H,4,8H2,1H3
InChIKeyLOUYNTQIAKVVPZ-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.58
Rot. Bonds2

About 2-amino-1-(5-methylfuran-2-yl)ethanol

2-amino-1-(5-methylfuran-2-yl)ethanol (PubChem CID 16768177) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is 2-amino-1-(5-methylfuran-2-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(5-methylfuran-2-yl)ethanol
PubChem CID16768177
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name2-amino-1-(5-methylfuran-2-yl)ethanol
SMILESCc1ccc(C(O)CN)o1
InChIInChI=1S/C7H11NO2/c1-5-2-3-7(10-5)6(9)4-8/h2-3,6,9H,4,8H2,1H3
InChIKeyLOUYNTQIAKVVPZ-UHFFFAOYSA-N
XLogP0.58
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(5-methylfuran-2-yl)ethanol?
The IUPAC name of 2-amino-1-(5-methylfuran-2-yl)ethanol (CID 16768177) is 2-amino-1-(5-methylfuran-2-yl)ethanol.
What is the SMILES notation for 2-amino-1-(5-methylfuran-2-yl)ethanol?
The canonical SMILES for 2-amino-1-(5-methylfuran-2-yl)ethanol is Cc1ccc(C(O)CN)o1.
What is the InChIKey of 2-amino-1-(5-methylfuran-2-yl)ethanol?
The InChIKey is LOUYNTQIAKVVPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c1-5-2-3-7(10-5)6(9)4-8/h2-3,6,9H,4,8H2,1H3.
What are the key properties of 2-amino-1-(5-methylfuran-2-yl)ethanol?
2-amino-1-(5-methylfuran-2-yl)ethanol has a molecular weight of 141.17 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(5-methylfuran-2-yl)ethanol is sourced from PubChem (CID 16768177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).