2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide

C6H6ClNO2S — CID 83530869

IUPAC2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide
SMILESNC(=O)C(O)c1ccc(Cl)s1
InChIInChI=1S/C6H6ClNO2S/c7-4-2-1-3(11-4)5(9)6(8)10/h1-2,5,9H,(H2,8,10)
InChIKeyMBFMSBQNUUWZMK-UHFFFAOYSA-N
MW191.64 g/mol
LogP0.92
Rot. Bonds2

About 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide

2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide (PubChem CID 83530869) has the molecular formula C6H6ClNO2S and a molecular weight of 191.64 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide
PubChem CID83530869
Molecular FormulaC6H6ClNO2S
Molecular Weight191.64 g/mol
Exact Mass190.98
IUPAC Name2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide
SMILESNC(=O)C(O)c1ccc(Cl)s1
InChIInChI=1S/C6H6ClNO2S/c7-4-2-1-3(11-4)5(9)6(8)10/h1-2,5,9H,(H2,8,10)
InChIKeyMBFMSBQNUUWZMK-UHFFFAOYSA-N
XLogP0.92
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.64
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide (CID 83530869) is 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide is NC(=O)C(O)c1ccc(Cl)s1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide?
The InChIKey is MBFMSBQNUUWZMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClNO2S/c7-4-2-1-3(11-4)5(9)6(8)10/h1-2,5,9H,(H2,8,10).
What are the key properties of 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide?
2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide has a molecular weight of 191.64 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)-2-hydroxyacetamide is sourced from PubChem (CID 83530869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).