2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide

C19H25NO3S — CID 78887943

IUPAC2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)NC(c2cccs2)C(C)(C)C)c1
InChIInChI=1S/C19H25NO3S/c1-19(2,3)18(16-7-6-10-24-16)20-17(21)12-13-11-14(22-4)8-9-15(13)23-5/h6-11,18H,12H2,1-5H3,(H,20,21)
InChIKeyYGLWBNWXENEAML-UHFFFAOYSA-N
MW347.48 g/mol
LogP4.21
Rot. Bonds6

About 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide

2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide (PubChem CID 78887943) has the molecular formula C19H25NO3S and a molecular weight of 347.48 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide
PubChem CID78887943
Molecular FormulaC19H25NO3S
Molecular Weight347.48 g/mol
Exact Mass347.16
IUPAC Name2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)NC(c2cccs2)C(C)(C)C)c1
InChIInChI=1S/C19H25NO3S/c1-19(2,3)18(16-7-6-10-24-16)20-17(21)12-13-11-14(22-4)8-9-15(13)23-5/h6-11,18H,12H2,1-5H3,(H,20,21)
InChIKeyYGLWBNWXENEAML-UHFFFAOYSA-N
XLogP4.21
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.48
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[[(1S)-2,2-dimethyl-1-thiophen-2-ylpropyl]amino]-2-oxoethyl] 2-methoxyacetate
CID 94352559
2-(2-methoxy-5-methylphenyl)-N-[phenyl(thiophen-2-yl)methyl]acetamide
CID 24682654
2-(2,5-dimethoxyphenyl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]acetamide
CID 28560338
2-(2,5-dimethoxyphenyl)-N-methoxyacetamide
CID 78829398
N-[3-[[2-(2,5-dimethoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
CID 78839112
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(2,5-dimethoxyphenyl)acetamide
CID 119607035
N-(1-thiophen-2-ylethyl)-2-(2,3,4-trimethoxyphenyl)acetamide
CID 18090212
N-(2,2-dimethyl-1-thiophen-2-ylpropyl)-3-methoxy-4-[2-(2-methoxyanilino)-2-oxoethoxy]benzamide
CID 55777976
N-[(1S)-2,2-dimethyl-1-thiophen-2-ylpropyl]-2-[(2-phenoxyacetyl)amino]acetamide
CID 94490347
N-(3-chloro-4-methoxyphenyl)-2-[(2,2-dimethyl-1-thiophen-2-ylpropyl)amino]acetamide
CID 60524145
2-(2,5-dimethoxyphenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 78806385
2-(2,5-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
CID 78820291

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide (CID 78887943) is 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide is COc1ccc(OC)c(CC(=O)NC(c2cccs2)C(C)(C)C)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide?
The InChIKey is YGLWBNWXENEAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO3S/c1-19(2,3)18(16-7-6-10-24-16)20-17(21)12-13-11-14(22-4)8-9-15(13)23-5/h6-11,18H,12H2,1-5H3,(H,20,21).
What are the key properties of 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide?
2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide has a molecular weight of 347.48 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide is sourced from PubChem (CID 78887943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).