1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine

C12H15NO2 — CID 65440345

IUPAC1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine
SMILESCCOc1ccc2oc(CNC)cc2c1
InChIInChI=1S/C12H15NO2/c1-3-14-10-4-5-12-9(6-10)7-11(15-12)8-13-2/h4-7,13H,3,8H2,1-2H3
InChIKeyRZVFINMWJKRQCA-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.55
Rot. Bonds4

About 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine

1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine (PubChem CID 65440345) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine
PubChem CID65440345
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine
SMILESCCOc1ccc2oc(CNC)cc2c1
InChIInChI=1S/C12H15NO2/c1-3-14-10-4-5-12-9(6-10)7-11(15-12)8-13-2/h4-7,13H,3,8H2,1-2H3
InChIKeyRZVFINMWJKRQCA-UHFFFAOYSA-N
XLogP2.55
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine (CID 65440345) is 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine is CCOc1ccc2oc(CNC)cc2c1.
What is the InChIKey of 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine?
The InChIKey is RZVFINMWJKRQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-3-14-10-4-5-12-9(6-10)7-11(15-12)8-13-2/h4-7,13H,3,8H2,1-2H3.
What are the key properties of 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine?
1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine has a molecular weight of 205.26 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine is sourced from PubChem (CID 65440345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).