1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine

C10H17NO2 — CID 105146670

IUPAC1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
SMILESCC(C)(C)OCC(N)c1ccoc1
InChIInChI=1S/C10H17NO2/c1-10(2,3)13-7-9(11)8-4-5-12-6-8/h4-6,9H,7,11H2,1-3H3
InChIKeyKLFVQXDLNNLHFB-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.09
Rot. Bonds3

About 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine

1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine (PubChem CID 105146670) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine.

Molecular Properties

Compound Name1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
PubChem CID105146670
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
SMILESCC(C)(C)OCC(N)c1ccoc1
InChIInChI=1S/C10H17NO2/c1-10(2,3)13-7-9(11)8-4-5-12-6-8/h4-6,9H,7,11H2,1-3H3
InChIKeyKLFVQXDLNNLHFB-UHFFFAOYSA-N
XLogP2.09
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine?
The IUPAC name of 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine (CID 105146670) is 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine.
What is the SMILES notation for 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine?
The canonical SMILES for 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine is CC(C)(C)OCC(N)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine?
The InChIKey is KLFVQXDLNNLHFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-10(2,3)13-7-9(11)8-4-5-12-6-8/h4-6,9H,7,11H2,1-3H3.
What are the key properties of 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine?
1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine has a molecular weight of 183.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine is sourced from PubChem (CID 105146670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).