2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide

C15H15F2N3O2S — CID 35824098

IUPAC2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
SMILESO=C(CNc1cc(F)cc(F)c1)NC(=O)NCCc1cccs1
InChIInChI=1S/C15H15F2N3O2S/c16-10-6-11(17)8-12(7-10)19-9-14(21)20-15(22)18-4-3-13-2-1-5-23-13/h1-2,5-8,19H,3-4,9H2,(H2,18,20,21,22)
InChIKeyZNIACAGZJHWELF-UHFFFAOYSA-N
MW339.37 g/mol
LogP2.51
Rot. Bonds6

About 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide

2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide (PubChem CID 35824098) has the molecular formula C15H15F2N3O2S and a molecular weight of 339.37 g/mol. Its IUPAC name is 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
PubChem CID35824098
Molecular FormulaC15H15F2N3O2S
Molecular Weight339.37 g/mol
Exact Mass339.09
IUPAC Name2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
SMILESO=C(CNc1cc(F)cc(F)c1)NC(=O)NCCc1cccs1
InChIInChI=1S/C15H15F2N3O2S/c16-10-6-11(17)8-12(7-10)19-9-14(21)20-15(22)18-4-3-13-2-1-5-23-13/h1-2,5-8,19H,3-4,9H2,(H2,18,20,21,22)
InChIKeyZNIACAGZJHWELF-UHFFFAOYSA-N
XLogP2.51
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-acetylanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 78807187
N-(3-fluorophenyl)-2-(2-thiophen-2-ylethylcarbamoylamino)acetamide
CID 134000907
2-(2,3-dimethylanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 51202795
2-(2-bromo-4-methylanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 55437044
N-(2-thiophen-2-ylethylcarbamoyl)-2-[2-(trifluoromethoxy)anilino]acetamide
CID 30644950
2-(2-ethoxyanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 43015979
N-(4-fluorophenyl)-2-(2-thiophen-2-ylethylcarbamoylamino)acetamide
CID 134000912
2-chloro-N-(2-methoxyethyl)-4-[[2-oxo-2-(2-thiophen-2-ylethylcarbamoylamino)ethyl]amino]benzamide
CID 55919274
2-(4-methoxyphenyl)sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 27562284
2-(2-bromophenyl)sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 36988394
2-(2,6-dimethylmorpholin-4-yl)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 51202772
3-fluoro-5-nitro-N-(2-thiophen-2-ylethyl)aniline
CID 60877639

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide?
The IUPAC name of 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide (CID 35824098) is 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide.
What is the SMILES notation for 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide?
The canonical SMILES for 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide is O=C(CNc1cc(F)cc(F)c1)NC(=O)NCCc1cccs1.
What is the InChIKey of 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide?
The InChIKey is ZNIACAGZJHWELF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N3O2S/c16-10-6-11(17)8-12(7-10)19-9-14(21)20-15(22)18-4-3-13-2-1-5-23-13/h1-2,5-8,19H,3-4,9H2,(H2,18,20,21,22).
What are the key properties of 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide?
2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide has a molecular weight of 339.37 g/mol, XLogP of 2.51, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluoroanilino)-N-(2-thiophen-2-ylethylcarbamoyl)acetamide is sourced from PubChem (CID 35824098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).