2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine

C12H15NO2 — CID 70557286

IUPAC2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine
SMILESCNCCc1cc2cccc(OC)c2o1
InChIInChI=1S/C12H15NO2/c1-13-7-6-10-8-9-4-3-5-11(14-2)12(9)15-10/h3-5,8,13H,6-7H2,1-2H3
InChIKeyHTMLFUFXLKPKCE-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.20
Rot. Bonds4

About 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine

2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine (PubChem CID 70557286) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine
PubChem CID70557286
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine
SMILESCNCCc1cc2cccc(OC)c2o1
InChIInChI=1S/C12H15NO2/c1-13-7-6-10-8-9-4-3-5-11(14-2)12(9)15-10/h3-5,8,13H,6-7H2,1-2H3
InChIKeyHTMLFUFXLKPKCE-UHFFFAOYSA-N
XLogP2.20
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 ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(7-methoxy-1-benzofuran-2-yl)ethyl]propan-1-amine
CID 70555736
2-(7-methoxy-1-benzofuran-2-yl)ethanamine
CID 66592603
N-methoxy-1-(7-methoxy-1-benzofuran-2-yl)methanamine
CID 82707164
N'-[(7-methoxy-1-benzofuran-2-yl)methyl]ethane-1,2-diamine
CID 19886076
4-methoxy-N-[(7-methoxy-1-benzofuran-2-yl)methyl]aniline
CID 43765976
2-(2,2-dimethylpropyl)-7-methoxy-1-benzofuran
CID 19075968
2-butoxy-N-[(7-methoxy-1-benzofuran-2-yl)methyl]ethanamine
CID 61169329
3-(7-methoxy-1-benzofuran-2-yl)-N-methyl-3-phenylpropan-1-amine
CID 58088427
2-iodo-7-methoxy-1-benzofuran
CID 147263066
N-[2-(1-benzofuran-2-yl)ethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 99809958
2-(3-fluorophenyl)-N-[(7-methoxy-1-benzofuran-2-yl)methyl]ethanamine
CID 55410255
5-fluoro-N-[(7-methoxy-1-benzofuran-2-yl)methyl]-2-methylaniline
CID 43764085

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine?
The IUPAC name of 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine (CID 70557286) is 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine is CNCCc1cc2cccc(OC)c2o1.
What is the InChIKey of 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine?
The InChIKey is HTMLFUFXLKPKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-13-7-6-10-8-9-4-3-5-11(14-2)12(9)15-10/h3-5,8,13H,6-7H2,1-2H3.
What are the key properties of 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine?
2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine has a molecular weight of 205.26 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-1-benzofuran-2-yl)-N-methylethanamine is sourced from PubChem (CID 70557286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).