N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide

C9H8N2OS2 — CID 18667979

IUPACN-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide
SMILESCC(=O)Nc1sccc1-c1cncs1
InChIInChI=1S/C9H8N2OS2/c1-6(12)11-9-7(2-3-13-9)8-4-10-5-14-8/h2-5H,1H3,(H,11,12)
InChIKeyBXUJYSJMFQCBCQ-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.83
Rot. Bonds2

About N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide

N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide (PubChem CID 18667979) has the molecular formula C9H8N2OS2 and a molecular weight of 224.31 g/mol. Its IUPAC name is N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide.

Molecular Properties

Compound NameN-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide
PubChem CID18667979
Molecular FormulaC9H8N2OS2
Molecular Weight224.31 g/mol
Exact Mass224.01
IUPAC NameN-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide
SMILESCC(=O)Nc1sccc1-c1cncs1
InChIInChI=1S/C9H8N2OS2/c1-6(12)11-9-7(2-3-13-9)8-4-10-5-14-8/h2-5H,1H3,(H,11,12)
InChIKeyBXUJYSJMFQCBCQ-UHFFFAOYSA-N
XLogP2.83
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide?
The IUPAC name of N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide (CID 18667979) is N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide.
What is the SMILES notation for N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide?
The canonical SMILES for N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide is CC(=O)Nc1sccc1-c1cncs1.
What is the InChIKey of N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide?
The InChIKey is BXUJYSJMFQCBCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS2/c1-6(12)11-9-7(2-3-13-9)8-4-10-5-14-8/h2-5H,1H3,(H,11,12).
What are the key properties of N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide?
N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide has a molecular weight of 224.31 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,3-thiazol-5-yl)thiophen-2-yl]acetamide is sourced from PubChem (CID 18667979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).