2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide

C8H9F3N2OS — CID 66353029

IUPAC2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CNc1ccsc1)NCC(F)(F)F
InChIInChI=1S/C8H9F3N2OS/c9-8(10,11)5-13-7(14)3-12-6-1-2-15-4-6/h1-2,4,12H,3,5H2,(H,13,14)
InChIKeyCFRNTFLRPKCZFW-UHFFFAOYSA-N
MW238.23 g/mol
LogP1.84
Rot. Bonds4

About 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide

2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 66353029) has the molecular formula C8H9F3N2OS and a molecular weight of 238.23 g/mol. Its IUPAC name is 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID66353029
Molecular FormulaC8H9F3N2OS
Molecular Weight238.23 g/mol
Exact Mass238.04
IUPAC Name2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CNc1ccsc1)NCC(F)(F)F
InChIInChI=1S/C8H9F3N2OS/c9-8(10,11)5-13-7(14)3-12-6-1-2-15-4-6/h1-2,4,12H,3,5H2,(H,13,14)
InChIKeyCFRNTFLRPKCZFW-UHFFFAOYSA-N
XLogP1.84
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.23
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-2-(thiophen-3-ylamino)acetamide
CID 66351485
2-anilino-N-(2,2,2-trifluoroethyl)acetamide;hydrochloride
CID 119726408
2-(4-methylanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60638136
N-cyclopropyl-2-(thiophen-3-ylamino)acetamide
CID 66350850
2-(2,6-dimethylanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60688864
2-(3,5-dichloro-4-fluoroanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 103579817
2-(3-acetamidoanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 37176536
2-(4-butylanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60684996
N-(2-thiophen-3-ylethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958029
N-(2-methylphenyl)-2-(thiophen-3-ylamino)acetamide
CID 66352372
2-(3-methoxyanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60646925
2-(5-fluoro-2-methylanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60652978

Frequently Asked Questions

What is the IUPAC name of 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide (CID 66353029) is 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide is O=C(CNc1ccsc1)NCC(F)(F)F.
What is the InChIKey of 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is CFRNTFLRPKCZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2OS/c9-8(10,11)5-13-7(14)3-12-6-1-2-15-4-6/h1-2,4,12H,3,5H2,(H,13,14).
What are the key properties of 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide?
2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 238.23 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophen-3-ylamino)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 66353029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).