1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone

C15H17NO2S — CID 60650482

IUPAC1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
SMILESCOc1ccccc1C(=O)CN(C)Cc1cccs1
InChIInChI=1S/C15H17NO2S/c1-16(10-12-6-5-9-19-12)11-14(17)13-7-3-4-8-15(13)18-2/h3-9H,10-11H2,1-2H3
InChIKeyUXOQHJDVNPFFEL-UHFFFAOYSA-N
MW275.37 g/mol
LogP3.07
Rot. Bonds6

About 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone

1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone (PubChem CID 60650482) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
PubChem CID60650482
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC Name1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
SMILESCOc1ccccc1C(=O)CN(C)Cc1cccs1
InChIInChI=1S/C15H17NO2S/c1-16(10-12-6-5-9-19-12)11-14(17)13-7-3-4-8-15(13)18-2/h3-9H,10-11H2,1-2H3
InChIKeyUXOQHJDVNPFFEL-UHFFFAOYSA-N
XLogP3.07
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone
CID 62052794
1-(2,5-dichlorothiophen-3-yl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 62050817
1-(4-methylphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 60650537
2-[(4-tert-butylphenyl)methyl-methylamino]-1-(2-methoxyphenyl)ethanone
CID 18333896
1-(1H-indol-3-yl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 60650536
2-methoxy-4-[[methyl(thiophen-2-ylmethyl)amino]methyl]benzoic acid
CID 106793477
2-(2-methoxyphenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 78762295
N-(4-ethylphenyl)-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 35180793
2-[2-ethoxyethyl(methyl)amino]-1-(2-methoxyphenyl)ethanone
CID 81058182
2-[(4-bromothiophen-2-yl)methyl-methylamino]-1-(2-methoxy-4-methylphenyl)ethanone
CID 62053047
2-hydroxy-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
CID 112795014
1-amino-3-[methyl(thiophen-2-ylmethyl)amino]propan-2-one
CID 112708944

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone?
The IUPAC name of 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone (CID 60650482) is 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone.
What is the SMILES notation for 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone?
The canonical SMILES for 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone is COc1ccccc1C(=O)CN(C)Cc1cccs1.
What is the InChIKey of 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone?
The InChIKey is UXOQHJDVNPFFEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c1-16(10-12-6-5-9-19-12)11-14(17)13-7-3-4-8-15(13)18-2/h3-9H,10-11H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone?
1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone has a molecular weight of 275.37 g/mol, XLogP of 3.07, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone is sourced from PubChem (CID 60650482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).