N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine

C10H17NO2 — CID 83171730

IUPACN-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine
SMILESCCCNCCOCc1ccoc1
InChIInChI=1S/C10H17NO2/c1-2-4-11-5-7-13-9-10-3-6-12-8-10/h3,6,8,11H,2,4-5,7,9H2,1H3
InChIKeyRVNYDSDFGBMNPJ-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.80
Rot. Bonds7

About N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine

N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine (PubChem CID 83171730) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine
PubChem CID83171730
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine
SMILESCCCNCCOCc1ccoc1
InChIInChI=1S/C10H17NO2/c1-2-4-11-5-7-13-9-10-3-6-12-8-10/h3,6,8,11H,2,4-5,7,9H2,1H3
InChIKeyRVNYDSDFGBMNPJ-UHFFFAOYSA-N
XLogP1.80
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.80
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-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine?
The IUPAC name of N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine (CID 83171730) is N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine?
The canonical SMILES for N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine is CCCNCCOCc1ccoc1.
What is the InChIKey of N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine?
The InChIKey is RVNYDSDFGBMNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-2-4-11-5-7-13-9-10-3-6-12-8-10/h3,6,8,11H,2,4-5,7,9H2,1H3.
What are the key properties of N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine?
N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine has a molecular weight of 183.25 g/mol, XLogP of 1.80, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-3-ylmethoxy)ethyl]propan-1-amine is sourced from PubChem (CID 83171730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).