1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine

C14H17NO2S2 — CID 64651150

IUPAC1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine
SMILESCNC(CS(=O)c1cccs1)c1ccccc1OC
InChIInChI=1S/C14H17NO2S2/c1-15-12(10-19(16)14-8-5-9-18-14)11-6-3-4-7-13(11)17-2/h3-9,12,15H,10H2,1-2H3
InChIKeyWWIHNZGEQJXLLP-UHFFFAOYSA-N
MW295.43 g/mol
LogP2.83
Rot. Bonds6

About 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine

1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine (PubChem CID 64651150) has the molecular formula C14H17NO2S2 and a molecular weight of 295.43 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine
PubChem CID64651150
Molecular FormulaC14H17NO2S2
Molecular Weight295.43 g/mol
Exact Mass295.07
IUPAC Name1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine
SMILESCNC(CS(=O)c1cccs1)c1ccccc1OC
InChIInChI=1S/C14H17NO2S2/c1-15-12(10-19(16)14-8-5-9-18-14)11-6-3-4-7-13(11)17-2/h3-9,12,15H,10H2,1-2H3
InChIKeyWWIHNZGEQJXLLP-UHFFFAOYSA-N
XLogP2.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyphenyl)-N-methyl-4-thiophen-2-ylbutan-1-amine
CID 105093570
1-(2-methoxyphenyl)-N-methyl-2-(2-methylbutylsulfinyl)ethanamine
CID 107760021
1-(2-methoxy-5-methylphenyl)-2-thiophen-2-ylsulfinylethanamine
CID 64652177
3-(methylamino)-4-thiophen-2-ylsulfinylbutan-1-ol
CID 64900182
1-(2-methoxyphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43483471
1-methoxy-3-thiophen-2-ylsulfinylpropan-2-amine
CID 107508763
N-methyl-2-thiophen-2-yl-1-[2-(trifluoromethoxy)phenyl]ethanamine
CID 62790932
4-(2-methoxyphenyl)-4-(methylamino)butanoic acid
CID 112517908
methyl 3-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]sulfonylpropanoate
CID 64676345
1-(2-ethoxyphenyl)-N-methyl-2-propylsulfinylethanamine
CID 64652372
1-(2-methoxyphenyl)-N-methylhexan-1-amine
CID 62608289
1-(2-methoxyphenyl)-2-(2-methoxyphenyl)sulfanyl-N-methylethanamine
CID 64627721

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine (CID 64651150) is 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine is CNC(CS(=O)c1cccs1)c1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine?
The InChIKey is WWIHNZGEQJXLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S2/c1-15-12(10-19(16)14-8-5-9-18-14)11-6-3-4-7-13(11)17-2/h3-9,12,15H,10H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine?
1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine has a molecular weight of 295.43 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-methyl-2-thiophen-2-ylsulfinylethanamine is sourced from PubChem (CID 64651150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).