2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine

C10H15NO2 — CID 103074355

IUPAC2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COCc1ccco1
InChIInChI=1S/C10H15NO2/c1-9(6-11-2)7-12-8-10-4-3-5-13-10/h3-5,11H,1,6-8H2,2H3
InChIKeyQFYPVWSGAPLYQZ-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.57
Rot. Bonds6

About 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine

2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine (PubChem CID 103074355) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine
PubChem CID103074355
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COCc1ccco1
InChIInChI=1S/C10H15NO2/c1-9(6-11-2)7-12-8-10-4-3-5-13-10/h3-5,11H,1,6-8H2,2H3
InChIKeyQFYPVWSGAPLYQZ-UHFFFAOYSA-N
XLogP1.57
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine?
The IUPAC name of 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine (CID 103074355) is 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine.
What is the SMILES notation for 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine?
The canonical SMILES for 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine is C=C(CNC)COCc1ccco1.
What is the InChIKey of 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine?
The InChIKey is QFYPVWSGAPLYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-9(6-11-2)7-12-8-10-4-3-5-13-10/h3-5,11H,1,6-8H2,2H3.
What are the key properties of 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine?
2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine has a molecular weight of 181.23 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine is sourced from PubChem (CID 103074355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).