N-ethyl-2-(furan-3-ylmethoxy)ethanamine

C9H15NO2 — CID 83171592

IUPACN-ethyl-2-(furan-3-ylmethoxy)ethanamine
SMILESCCNCCOCc1ccoc1
InChIInChI=1S/C9H15NO2/c1-2-10-4-6-12-8-9-3-5-11-7-9/h3,5,7,10H,2,4,6,8H2,1H3
InChIKeyQTGJNRNJGLXSTF-UHFFFAOYSA-N
MW169.22 g/mol
LogP1.41
Rot. Bonds6

About N-ethyl-2-(furan-3-ylmethoxy)ethanamine

N-ethyl-2-(furan-3-ylmethoxy)ethanamine (PubChem CID 83171592) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is N-ethyl-2-(furan-3-ylmethoxy)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(furan-3-ylmethoxy)ethanamine
PubChem CID83171592
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC NameN-ethyl-2-(furan-3-ylmethoxy)ethanamine
SMILESCCNCCOCc1ccoc1
InChIInChI=1S/C9H15NO2/c1-2-10-4-6-12-8-9-3-5-11-7-9/h3,5,7,10H,2,4,6,8H2,1H3
InChIKeyQTGJNRNJGLXSTF-UHFFFAOYSA-N
XLogP1.41
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.41
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 N-ethyl-2-(furan-3-ylmethoxy)ethanamine?
The IUPAC name of N-ethyl-2-(furan-3-ylmethoxy)ethanamine (CID 83171592) is N-ethyl-2-(furan-3-ylmethoxy)ethanamine.
What is the SMILES notation for N-ethyl-2-(furan-3-ylmethoxy)ethanamine?
The canonical SMILES for N-ethyl-2-(furan-3-ylmethoxy)ethanamine is CCNCCOCc1ccoc1.
What is the InChIKey of N-ethyl-2-(furan-3-ylmethoxy)ethanamine?
The InChIKey is QTGJNRNJGLXSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-2-10-4-6-12-8-9-3-5-11-7-9/h3,5,7,10H,2,4,6,8H2,1H3.
What are the key properties of N-ethyl-2-(furan-3-ylmethoxy)ethanamine?
N-ethyl-2-(furan-3-ylmethoxy)ethanamine has a molecular weight of 169.22 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(furan-3-ylmethoxy)ethanamine is sourced from PubChem (CID 83171592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).