1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine

C14H19NO2 — CID 113459832

IUPAC1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine
SMILESCCOc1ccc2oc(CNC)c(CC)c2c1
InChIInChI=1S/C14H19NO2/c1-4-11-12-8-10(16-5-2)6-7-13(12)17-14(11)9-15-3/h6-8,15H,4-5,9H2,1-3H3
InChIKeyXZRJIAWSXDXZJI-UHFFFAOYSA-N
MW233.31 g/mol
LogP3.11
Rot. Bonds5

About 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine

1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine (PubChem CID 113459832) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine
PubChem CID113459832
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine
SMILESCCOc1ccc2oc(CNC)c(CC)c2c1
InChIInChI=1S/C14H19NO2/c1-4-11-12-8-10(16-5-2)6-7-13(12)17-14(11)9-15-3/h6-8,15H,4-5,9H2,1-3H3
InChIKeyXZRJIAWSXDXZJI-UHFFFAOYSA-N
XLogP3.11
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-5-fluoro-1-benzofuran-2-yl)-N-methylmethanamine
CID 104842839
1-(5-tert-butyl-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine
CID 113459838
N-[[5-ethoxy-3-(2-methylpropyl)-1-benzofuran-2-yl]methyl]propan-2-amine
CID 114376303
1-(5-benzyl-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine
CID 104843134
N-[(5-ethoxy-3-methyl-1-benzofuran-2-yl)methyl]ethanamine
CID 81049006
1-(5-ethoxy-1-benzofuran-2-yl)-N-methylmethanamine
CID 65440345
1-(7-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine
CID 104842971
(3-cyclopropyl-5-ethoxy-1-benzofuran-2-yl)methanamine
CID 114376299
5-ethoxy-3-methoxy-1-benzofuran-2-ol
CID 150105787
2-ethoxyxanthen-9-one
CID 14150405
6-ethoxy-4-methoxychromen-2-one
CID 90255456
6-ethoxy-4-propylchromen-2-one
CID 134087770

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine (CID 113459832) is 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine is CCOc1ccc2oc(CNC)c(CC)c2c1.
What is the InChIKey of 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine?
The InChIKey is XZRJIAWSXDXZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-4-11-12-8-10(16-5-2)6-7-13(12)17-14(11)9-15-3/h6-8,15H,4-5,9H2,1-3H3.
What are the key properties of 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine?
1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine has a molecular weight of 233.31 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethoxy-3-ethyl-1-benzofuran-2-yl)-N-methylmethanamine is sourced from PubChem (CID 113459832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).