2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide

C12H19NO2S — CID 103029178

IUPAC2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide
SMILESCCC(NC(=O)C(C)(C)OC)c1cccs1
InChIInChI=1S/C12H19NO2S/c1-5-9(10-7-6-8-16-10)13-11(14)12(2,3)15-4/h6-9H,5H2,1-4H3,(H,13,14)
InChIKeyUEEODEHLLDEWIE-UHFFFAOYSA-N
MW241.36 g/mol
LogP2.74
Rot. Bonds5

About 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide

2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide (PubChem CID 103029178) has the molecular formula C12H19NO2S and a molecular weight of 241.36 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide
PubChem CID103029178
Molecular FormulaC12H19NO2S
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC Name2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide
SMILESCCC(NC(=O)C(C)(C)OC)c1cccs1
InChIInChI=1S/C12H19NO2S/c1-5-9(10-7-6-8-16-10)13-11(14)12(2,3)15-4/h6-9H,5H2,1-4H3,(H,13,14)
InChIKeyUEEODEHLLDEWIE-UHFFFAOYSA-N
XLogP2.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide (CID 103029178) is 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide is CCC(NC(=O)C(C)(C)OC)c1cccs1.
What is the InChIKey of 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide?
The InChIKey is UEEODEHLLDEWIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2S/c1-5-9(10-7-6-8-16-10)13-11(14)12(2,3)15-4/h6-9H,5H2,1-4H3,(H,13,14).
What are the key properties of 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide?
2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide has a molecular weight of 241.36 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-(1-thiophen-2-ylpropyl)propanamide is sourced from PubChem (CID 103029178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).