1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine

C10H16BrNO2 — CID 106858103

IUPAC1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine
SMILESCCNC(COCC)c1ccoc1Br
InChIInChI=1S/C10H16BrNO2/c1-3-12-9(7-13-4-2)8-5-6-14-10(8)11/h5-6,9,12H,3-4,7H2,1-2H3
InChIKeyYYOHHKSZVVQTTF-UHFFFAOYSA-N
MW262.15 g/mol
LogP2.73
Rot. Bonds6

About 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine

1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine (PubChem CID 106858103) has the molecular formula C10H16BrNO2 and a molecular weight of 262.15 g/mol. Its IUPAC name is 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine.

Molecular Properties

Compound Name1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine
PubChem CID106858103
Molecular FormulaC10H16BrNO2
Molecular Weight262.15 g/mol
Exact Mass261.04
IUPAC Name1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine
SMILESCCNC(COCC)c1ccoc1Br
InChIInChI=1S/C10H16BrNO2/c1-3-12-9(7-13-4-2)8-5-6-14-10(8)11/h5-6,9,12H,3-4,7H2,1-2H3
InChIKeyYYOHHKSZVVQTTF-UHFFFAOYSA-N
XLogP2.73
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.15
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 104790093
1-(2-bromofuran-3-yl)-N-ethylbutan-1-amine
CID 106856875
1-(2-bromofuran-3-yl)-N-ethyl-3-methylbutan-1-amine
CID 106856891
1-(2-bromofuran-3-yl)-N-ethyldecan-1-amine
CID 106857211
1-(2,4-dibromophenyl)-2-ethoxy-N-ethylethanamine
CID 107946286
1-(5-bromo-2-methylphenyl)-2-ethoxy-N-ethylethanamine
CID 105007898
1-(2-bromofuran-3-yl)-2-(2-chlorophenyl)-N-ethylethanamine
CID 106854656
1-(2-bromofuran-3-yl)-N-ethyl-2-(2,4,6-trimethylphenyl)ethanamine
CID 106857185
1-(2-bromo-3-fluorophenyl)-2-ethoxy-N-ethylethanamine
CID 105008231
1-(5-bromo-2-chlorophenyl)-2-ethoxy-N-ethylethanamine
CID 105008140
1-(2-bromo-5-methoxyphenyl)-2-ethoxy-N-ethylethanamine
CID 105164999
1-(2-bromofuran-3-yl)-2-(2,3-difluorophenyl)-N-ethylethanamine
CID 106854724

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine?
The IUPAC name of 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine (CID 106858103) is 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine.
What is the SMILES notation for 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine?
The canonical SMILES for 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine is CCNC(COCC)c1ccoc1Br.
What is the InChIKey of 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine?
The InChIKey is YYOHHKSZVVQTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrNO2/c1-3-12-9(7-13-4-2)8-5-6-14-10(8)11/h5-6,9,12H,3-4,7H2,1-2H3.
What are the key properties of 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine?
1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine has a molecular weight of 262.15 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromofuran-3-yl)-2-ethoxy-N-ethylethanamine is sourced from PubChem (CID 106858103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).