2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide

C6H5ClN4O2S — CID 14517583

IUPAC2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide
SMILESNS(=O)(=O)c1c(Cl)nc2ncccn12
InChIInChI=1S/C6H5ClN4O2S/c7-4-5(14(8,12)13)11-3-1-2-9-6(11)10-4/h1-3H,(H2,8,12,13)
InChIKeyHXKFQWQQESLKTJ-UHFFFAOYSA-N
MW232.65 g/mol
LogP0.03
Rot. Bonds1

About 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide

2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide (PubChem CID 14517583) has the molecular formula C6H5ClN4O2S and a molecular weight of 232.65 g/mol. Its IUPAC name is 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide.

Molecular Properties

Compound Name2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide
PubChem CID14517583
Molecular FormulaC6H5ClN4O2S
Molecular Weight232.65 g/mol
Exact Mass231.98
IUPAC Name2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide
SMILESNS(=O)(=O)c1c(Cl)nc2ncccn12
InChIInChI=1S/C6H5ClN4O2S/c7-4-5(14(8,12)13)11-3-1-2-9-6(11)10-4/h1-3H,(H2,8,12,13)
InChIKeyHXKFQWQQESLKTJ-UHFFFAOYSA-N
XLogP0.03
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.65
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide?
The IUPAC name of 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide (CID 14517583) is 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide.
What is the SMILES notation for 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide?
The canonical SMILES for 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide is NS(=O)(=O)c1c(Cl)nc2ncccn12.
What is the InChIKey of 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide?
The InChIKey is HXKFQWQQESLKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClN4O2S/c7-4-5(14(8,12)13)11-3-1-2-9-6(11)10-4/h1-3H,(H2,8,12,13).
What are the key properties of 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide?
2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide has a molecular weight of 232.65 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloroimidazo[1,2-a]pyrimidine-3-sulfonamide is sourced from PubChem (CID 14517583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).