2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H8ClFN4O2S — CID 63903849

IUPAC2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(F)cn1)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H8ClFN4O2S/c13-11-12(18-6-2-1-3-10(18)16-11)21(19,20)17-9-5-4-8(14)7-15-9/h1-7H,(H,15,17)
InChIKeyNKKXNCWUQVHWKR-UHFFFAOYSA-N
MW326.74 g/mol
LogP2.32
Rot. Bonds3

About 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 63903849) has the molecular formula C12H8ClFN4O2S and a molecular weight of 326.74 g/mol. Its IUPAC name is 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID63903849
Molecular FormulaC12H8ClFN4O2S
Molecular Weight326.74 g/mol
Exact Mass326.00
IUPAC Name2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(F)cn1)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H8ClFN4O2S/c13-11-12(18-6-2-1-3-10(18)16-11)21(19,20)17-9-5-4-8(14)7-15-9/h1-7H,(H,15,17)
InChIKeyNKKXNCWUQVHWKR-UHFFFAOYSA-N
XLogP2.32
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.74
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 63903849) is 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide is O=S(=O)(Nc1ccc(F)cn1)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is NKKXNCWUQVHWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFN4O2S/c13-11-12(18-6-2-1-3-10(18)16-11)21(19,20)17-9-5-4-8(14)7-15-9/h1-7H,(H,15,17).
What are the key properties of 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 326.74 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5-fluoro-2-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 63903849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).