2-(furan-3-ylmethoxy)ethanamine

C7H11NO2 — CID 83171997

IUPAC2-(furan-3-ylmethoxy)ethanamine
SMILESNCCOCc1ccoc1
InChIInChI=1S/C7H11NO2/c8-2-4-10-6-7-1-3-9-5-7/h1,3,5H,2,4,6,8H2
InChIKeySTHJFJYGWBMBGJ-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.75
Rot. Bonds4

About 2-(furan-3-ylmethoxy)ethanamine

2-(furan-3-ylmethoxy)ethanamine (PubChem CID 83171997) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is 2-(furan-3-ylmethoxy)ethanamine.

Molecular Properties

Compound Name2-(furan-3-ylmethoxy)ethanamine
PubChem CID83171997
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name2-(furan-3-ylmethoxy)ethanamine
SMILESNCCOCc1ccoc1
InChIInChI=1S/C7H11NO2/c8-2-4-10-6-7-1-3-9-5-7/h1,3,5H,2,4,6,8H2
InChIKeySTHJFJYGWBMBGJ-UHFFFAOYSA-N
XLogP0.75
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-ylmethoxy)ethanamine?
The IUPAC name of 2-(furan-3-ylmethoxy)ethanamine (CID 83171997) is 2-(furan-3-ylmethoxy)ethanamine.
What is the SMILES notation for 2-(furan-3-ylmethoxy)ethanamine?
The canonical SMILES for 2-(furan-3-ylmethoxy)ethanamine is NCCOCc1ccoc1.
What is the InChIKey of 2-(furan-3-ylmethoxy)ethanamine?
The InChIKey is STHJFJYGWBMBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c8-2-4-10-6-7-1-3-9-5-7/h1,3,5H,2,4,6,8H2.
What are the key properties of 2-(furan-3-ylmethoxy)ethanamine?
2-(furan-3-ylmethoxy)ethanamine has a molecular weight of 141.17 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-ylmethoxy)ethanamine is sourced from PubChem (CID 83171997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).