2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H8ClFN4O2S — CID 103775694

IUPAC2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(F)nc1)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H8ClFN4O2S/c13-11-12(18-6-2-1-3-10(18)16-11)21(19,20)17-8-4-5-9(14)15-7-8/h1-7,17H
InChIKeySDMVWOPUNNLNSS-UHFFFAOYSA-N
MW326.74 g/mol
LogP2.32
Rot. Bonds3

About 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 103775694) has the molecular formula C12H8ClFN4O2S and a molecular weight of 326.74 g/mol. Its IUPAC name is 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID103775694
Molecular FormulaC12H8ClFN4O2S
Molecular Weight326.74 g/mol
Exact Mass326.00
IUPAC Name2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(F)nc1)c1c(Cl)nc2ccccn12
InChIInChI=1S/C12H8ClFN4O2S/c13-11-12(18-6-2-1-3-10(18)16-11)21(19,20)17-8-4-5-9(14)15-7-8/h1-7,17H
InChIKeySDMVWOPUNNLNSS-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-thiophen-3-ylimidazo[1,2-a]pyridine-3-sulfonamide
CID 66352387
2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 167864289
3-[4-[(2-chloroimidazo[1,2-a]pyridin-3-yl)sulfonylamino]phenyl]-2-methylpropanoic acid
CID 86790432
2-chloroimidazo[1,2-a]pyridine-3-sulfonamide
CID 14422354
N-(2-chloroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-fluorophenyl)prop-2-enamide
CID 76877969
(E)-N-(2-chloroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-fluorophenyl)prop-2-enamide
CID 60602884
2-chloro-N-(2-methylbutyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 62693085
2-chloro-N-[2-(dimethylamino)propyl]imidazo[1,2-a]pyridine-3-sulfonamide
CID 61045081
N-(2-chloroimidazo[1,2-a]pyridin-3-yl)sulfonyl-2-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 86868904
3,5-dichloro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775753
2-amino-N-pyrimidin-5-ylimidazo[1,2-a]pyridine-3-sulfonamide
CID 107589877
2-chloro-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 115591341

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 103775694) is 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide is O=S(=O)(Nc1ccc(F)nc1)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is SDMVWOPUNNLNSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFN4O2S/c13-11-12(18-6-2-1-3-10(18)16-11)21(19,20)17-8-4-5-9(14)15-7-8/h1-7,17H.
What are the key properties of 2-chloro-N-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(6-fluoro-3-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-(6-fluoro-3-pyridinyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 103775694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).