N-(4,5-dichlorothiophen-2-yl)acetamide

C6H5Cl2NOS — CID 16640236

IUPACN-(4,5-dichlorothiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc(Cl)c(Cl)s1
InChIInChI=1S/C6H5Cl2NOS/c1-3(10)9-5-2-4(7)6(8)11-5/h2H,1H3,(H,9,10)
InChIKeyWUVNPYYFDQBPKN-UHFFFAOYSA-N
MW210.09 g/mol
LogP3.01
Rot. Bonds1

About N-(4,5-dichlorothiophen-2-yl)acetamide

N-(4,5-dichlorothiophen-2-yl)acetamide (PubChem CID 16640236) has the molecular formula C6H5Cl2NOS and a molecular weight of 210.09 g/mol. Its IUPAC name is N-(4,5-dichlorothiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(4,5-dichlorothiophen-2-yl)acetamide
PubChem CID16640236
Molecular FormulaC6H5Cl2NOS
Molecular Weight210.09 g/mol
Exact Mass208.95
IUPAC NameN-(4,5-dichlorothiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc(Cl)c(Cl)s1
InChIInChI=1S/C6H5Cl2NOS/c1-3(10)9-5-2-4(7)6(8)11-5/h2H,1H3,(H,9,10)
InChIKeyWUVNPYYFDQBPKN-UHFFFAOYSA-N
XLogP3.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.09
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dichlorothiophen-2-yl)acetamide?
The IUPAC name of N-(4,5-dichlorothiophen-2-yl)acetamide (CID 16640236) is N-(4,5-dichlorothiophen-2-yl)acetamide.
What is the SMILES notation for N-(4,5-dichlorothiophen-2-yl)acetamide?
The canonical SMILES for N-(4,5-dichlorothiophen-2-yl)acetamide is CC(=O)Nc1cc(Cl)c(Cl)s1.
What is the InChIKey of N-(4,5-dichlorothiophen-2-yl)acetamide?
The InChIKey is WUVNPYYFDQBPKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2NOS/c1-3(10)9-5-2-4(7)6(8)11-5/h2H,1H3,(H,9,10).
What are the key properties of N-(4,5-dichlorothiophen-2-yl)acetamide?
N-(4,5-dichlorothiophen-2-yl)acetamide has a molecular weight of 210.09 g/mol, XLogP of 3.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dichlorothiophen-2-yl)acetamide is sourced from PubChem (CID 16640236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).