1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine

C9H14ClNO2 — CID 106692547

IUPAC1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine
SMILESCCOCC(NC)c1ccc(Cl)o1
InChIInChI=1S/C9H14ClNO2/c1-3-12-6-7(11-2)8-4-5-9(10)13-8/h4-5,7,11H,3,6H2,1-2H3
InChIKeyYHDKVGUJEWIEDC-UHFFFAOYSA-N
MW203.67 g/mol
LogP2.23
Rot. Bonds5

About 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine

1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine (PubChem CID 106692547) has the molecular formula C9H14ClNO2 and a molecular weight of 203.67 g/mol. Its IUPAC name is 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine.

Molecular Properties

Compound Name1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine
PubChem CID106692547
Molecular FormulaC9H14ClNO2
Molecular Weight203.67 g/mol
Exact Mass203.07
IUPAC Name1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine
SMILESCCOCC(NC)c1ccc(Cl)o1
InChIInChI=1S/C9H14ClNO2/c1-3-12-6-7(11-2)8-4-5-9(10)13-8/h4-5,7,11H,3,6H2,1-2H3
InChIKeyYHDKVGUJEWIEDC-UHFFFAOYSA-N
XLogP2.23
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-chlorofuran-2-yl)-N,3-dimethylbutan-1-amine
CID 112709867
1-(5-chlorofuran-2-yl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 106691674
1-(5-chlorofuran-2-yl)-2-(5-chloro-2-methoxyphenyl)-N-methylethanamine
CID 106691825
1-(5-chlorofuran-2-yl)propylhydrazine
CID 106694131
1-(5-chlorofuran-2-yl)-N-ethylpropan-1-amine
CID 106691408
1-(5-chlorofuran-2-yl)-N-methyl-2-pyridin-4-ylethanamine
CID 106688071
1-(5-chlorofuran-2-yl)-5,5,5-trifluoro-N-methylpentan-1-amine
CID 106692847
2-ethoxy-N-methyl-1-(3-methylfuran-2-yl)ethanamine
CID 104804689
[2-ethoxy-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105321280
N-[1-(5-bromofuran-2-yl)-2-ethoxyethyl]propan-1-amine
CID 105007868
2-ethoxy-N-methyl-1-(2,3,4-trimethoxyphenyl)ethanamine
CID 105008034
2-ethoxy-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 105007859

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine?
The IUPAC name of 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine (CID 106692547) is 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine.
What is the SMILES notation for 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine?
The canonical SMILES for 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine is CCOCC(NC)c1ccc(Cl)o1.
What is the InChIKey of 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine?
The InChIKey is YHDKVGUJEWIEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClNO2/c1-3-12-6-7(11-2)8-4-5-9(10)13-8/h4-5,7,11H,3,6H2,1-2H3.
What are the key properties of 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine?
1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine has a molecular weight of 203.67 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorofuran-2-yl)-2-ethoxy-N-methylethanamine is sourced from PubChem (CID 106692547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).