2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide

C14H13NO3S — CID 7762764

IUPAC2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
SMILESO=Cc1ccccc1OCC(=O)NCc1cccs1
InChIInChI=1S/C14H13NO3S/c16-9-11-4-1-2-6-13(11)18-10-14(17)15-8-12-5-3-7-19-12/h1-7,9H,8,10H2,(H,15,17)
InChIKeyUACFXQVWJKIBEA-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.26
Rot. Bonds6

About 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide

2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 7762764) has the molecular formula C14H13NO3S and a molecular weight of 275.33 g/mol. Its IUPAC name is 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID7762764
Molecular FormulaC14H13NO3S
Molecular Weight275.33 g/mol
Exact Mass275.06
IUPAC Name2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
SMILESO=Cc1ccccc1OCC(=O)NCc1cccs1
InChIInChI=1S/C14H13NO3S/c16-9-11-4-1-2-6-13(11)18-10-14(17)15-8-12-5-3-7-19-12/h1-7,9H,8,10H2,(H,15,17)
InChIKeyUACFXQVWJKIBEA-UHFFFAOYSA-N
XLogP2.26
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[2-oxo-2-(thiophen-2-ylmethylamino)ethoxy]benzoate
CID 7894213
bis[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] (E)-but-2-enedioate
CID 35700522
2-(2-formylphenoxy)-N-[[4-(phenoxymethyl)phenyl]methyl]acetamide
CID 60513930
2-(2-formyl-4-nitrophenoxy)-N-(2-thiophen-2-ylethyl)acetamide
CID 8951874
[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-(2-cyanophenoxy)acetate
CID 9275268
5-methyl-2-[2-oxo-2-(thiophen-2-ylmethylamino)ethoxy]benzoic acid
CID 60652928
[2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-(2-nitrophenoxy)acetate
CID 2626600
2-(4-cyanophenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 2520951
2-[4-(4-fluorobenzoyl)phenoxy]-N-(thiophen-2-ylmethyl)acetamide
CID 2427182
N-[4-[[[2-(2-formylphenoxy)acetyl]amino]methyl]phenyl]furan-2-carboxamide
CID 30332762
2-(2-formylphenoxy)-N-[(2S)-2-phenylpropyl]acetamide
CID 7762724
2-thiophen-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 1245174

Frequently Asked Questions

What is the IUPAC name of 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide (CID 7762764) is 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide is O=Cc1ccccc1OCC(=O)NCc1cccs1.
What is the InChIKey of 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is UACFXQVWJKIBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO3S/c16-9-11-4-1-2-6-13(11)18-10-14(17)15-8-12-5-3-7-19-12/h1-7,9H,8,10H2,(H,15,17).
What are the key properties of 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 275.33 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 7762764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).