N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide

C14H13FN2O2S — CID 49335870

IUPACN-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H13FN2O2S/c15-10-3-1-4-11(7-10)17-14(19)9-16-13(18)8-12-5-2-6-20-12/h1-7H,8-9H2,(H,16,18)(H,17,19)
InChIKeyJDJUAFLGSSDCPK-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.18
Rot. Bonds5

About N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide

N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide (PubChem CID 49335870) has the molecular formula C14H13FN2O2S and a molecular weight of 292.34 g/mol. Its IUPAC name is N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
PubChem CID49335870
Molecular FormulaC14H13FN2O2S
Molecular Weight292.34 g/mol
Exact Mass292.07
IUPAC NameN-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCC(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H13FN2O2S/c15-10-3-1-4-11(7-10)17-14(19)9-16-13(18)8-12-5-2-6-20-12/h1-7H,8-9H2,(H,16,18)(H,17,19)
InChIKeyJDJUAFLGSSDCPK-UHFFFAOYSA-N
XLogP2.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,4-difluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
CID 17395086
N-(3-fluorophenyl)-2-(2-thiophen-2-ylethylcarbamoylamino)acetamide
CID 134000907
N-(3-fluorophenyl)-2-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 38269111
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 49335487
3-fluoro-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]benzamide
CID 108542051
2-[4-[2-(3-fluoroanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]-N-(2-thiophen-2-ylethyl)acetamide
CID 9044697
N-[2-oxo-2-(4-propan-2-ylanilino)ethyl]-2-thiophen-2-ylacetamide
CID 112997181
methyl 4-[[2-[(2-thiophen-2-ylacetyl)amino]acetyl]amino]benzoate
CID 112999942
N-[3-(3-fluoroanilino)-3-oxopropyl]thiophene-2-carboxamide
CID 17499765
N-(3-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)acetamide
CID 4615673
N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-thiophen-2-ylacetamide
CID 110370222
2-thiophen-2-yl-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]acetamide
CID 25146649

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide (CID 49335870) is N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NCC(=O)Nc1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The InChIKey is JDJUAFLGSSDCPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2S/c15-10-3-1-4-11(7-10)17-14(19)9-16-13(18)8-12-5-2-6-20-12/h1-7H,8-9H2,(H,16,18)(H,17,19).
What are the key properties of N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide has a molecular weight of 292.34 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluoroanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 49335870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).