2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide

C8H8F3NOS — CID 62726521

IUPAC2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide
SMILESO=C(NCCc1ccsc1)C(F)(F)F
InChIInChI=1S/C8H8F3NOS/c9-8(10,11)7(13)12-3-1-6-2-4-14-5-6/h2,4-5H,1,3H2,(H,12,13)
InChIKeyLHLZHKPRPCUXCC-UHFFFAOYSA-N
MW223.22 g/mol
LogP1.97
Rot. Bonds3

About 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide

2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide (PubChem CID 62726521) has the molecular formula C8H8F3NOS and a molecular weight of 223.22 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide
PubChem CID62726521
Molecular FormulaC8H8F3NOS
Molecular Weight223.22 g/mol
Exact Mass223.03
IUPAC Name2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide
SMILESO=C(NCCc1ccsc1)C(F)(F)F
InChIInChI=1S/C8H8F3NOS/c9-8(10,11)7(13)12-3-1-6-2-4-14-5-6/h2,4-5H,1,3H2,(H,12,13)
InChIKeyLHLZHKPRPCUXCC-UHFFFAOYSA-N
XLogP1.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.22
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2,2-dimethyl-N-(2-thiophen-3-ylethyl)propanamide
CID 81489154
N-(2-thiophen-3-ylethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958029
2-ethoxy-2-methyl-N-(2-thiophen-3-ylethyl)propanamide
CID 145215422
2-carbamothioyl-2-methyl-N-(2-thiophen-3-ylethyl)butanamide
CID 113270556
N-[2-(4-aminophenyl)ethyl]-2,2,2-trifluoroacetamide;hydrochloride
CID 22906098
N-(2-thiophen-3-ylethyl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 122152494
2,6-dihydroxy-N-(2-thiophen-3-ylethyl)benzamide
CID 103890273
N-(2-thiophen-3-ylethyl)pyrimidine-2-carboxamide
CID 170939358
N'-(cyanomethyl)-N-(2-thiophen-3-ylethyl)oxamide
CID 61477384
1,1,1-trifluoro-3-thiophen-3-ylpropan-2-one
CID 14399209
N-(2-thiophen-3-ylethyl)-1H-pyrrole-2-carboxamide
CID 110475807
3-amino-3-hydroxyimino-N-(2-thiophen-3-ylethyl)propanamide
CID 61475450

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide (CID 62726521) is 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide is O=C(NCCc1ccsc1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide?
The InChIKey is LHLZHKPRPCUXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NOS/c9-8(10,11)7(13)12-3-1-6-2-4-14-5-6/h2,4-5H,1,3H2,(H,12,13).
What are the key properties of 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide?
2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide has a molecular weight of 223.22 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-thiophen-3-ylethyl)acetamide is sourced from PubChem (CID 62726521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).