2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide

C9H9N3OS2 — CID 66351961

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide
SMILESNc1nc(CC(=O)Nc2ccsc2)cs1
InChIInChI=1S/C9H9N3OS2/c10-9-12-7(5-15-9)3-8(13)11-6-1-2-14-4-6/h1-2,4-5H,3H2,(H2,10,12)(H,11,13)
InChIKeyXSZDCIXTRQENQP-UHFFFAOYSA-N
MW239.33 g/mol
LogP1.97
Rot. Bonds3

About 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide

2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide (PubChem CID 66351961) has the molecular formula C9H9N3OS2 and a molecular weight of 239.33 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide
PubChem CID66351961
Molecular FormulaC9H9N3OS2
Molecular Weight239.33 g/mol
Exact Mass239.02
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide
SMILESNc1nc(CC(=O)Nc2ccsc2)cs1
InChIInChI=1S/C9H9N3OS2/c10-9-12-7(5-15-9)3-8(13)11-6-1-2-14-4-6/h1-2,4-5H,3H2,(H2,10,12)(H,11,13)
InChIKeyXSZDCIXTRQENQP-UHFFFAOYSA-N
XLogP1.97
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.33
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-amino-1,3-thiazol-4-yl)-N-pyridin-4-ylacetamide
CID 62795383
2-(2-amino-1,3-thiazol-4-yl)-N-(4-iodophenyl)acetamide
CID 12686359
2-[4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]phenyl]acetamide
CID 62798897
2-(2-amino-1,3-thiazol-4-yl)-N-(1-benzothiophen-5-yl)acetamide
CID 62798357
2-(2-amino-1,3-thiazol-4-yl)-N-(3-chlorophenyl)acetamide
CID 55120912
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]benzoic acid
CID 55120222
2-(2-amino-1,3-thiazol-4-yl)-N-(3,5-dichloro-4-fluorophenyl)acetamide
CID 107574425
2-(2-amino-1,3-thiazol-4-yl)-N-[4-(trifluoromethylsulfanyl)phenyl]acetamide
CID 62797826
2-(2-amino-1,3-thiazol-4-yl)-N-[3-(methoxymethyl)phenyl]acetamide
CID 62799415
2-(2-amino-1,3-thiazol-4-yl)-N-[4-(3-methylbutyl)phenyl]acetamide
CID 167218752
2-(2-amino-1,3-thiazol-4-yl)-N-(6-methylsulfonyl-3-pyridinyl)acetamide
CID 62797643
4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-2-chlorobenzoic acid
CID 62800000

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide (CID 66351961) is 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide is Nc1nc(CC(=O)Nc2ccsc2)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide?
The InChIKey is XSZDCIXTRQENQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS2/c10-9-12-7(5-15-9)3-8(13)11-6-1-2-14-4-6/h1-2,4-5H,3H2,(H2,10,12)(H,11,13).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide has a molecular weight of 239.33 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide is sourced from PubChem (CID 66351961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).