7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide

C15H9ClF2N4O2S — CID 170733486

IUPAC7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide
SMILESN#CCc1cc(F)c(NS(=O)(=O)c2cnc3cc(Cl)ccn23)cc1F
InChIInChI=1S/C15H9ClF2N4O2S/c16-10-2-4-22-14(6-10)20-8-15(22)25(23,24)21-13-7-11(17)9(1-3-19)5-12(13)18/h2,4-8,21H,1H2
InChIKeyPNPFHLXWFQBELE-UHFFFAOYSA-N
MW382.78 g/mol
LogP3.13
Rot. Bonds4

About 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide

7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 170733486) has the molecular formula C15H9ClF2N4O2S and a molecular weight of 382.78 g/mol. Its IUPAC name is 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID170733486
Molecular FormulaC15H9ClF2N4O2S
Molecular Weight382.78 g/mol
Exact Mass382.01
IUPAC Name7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide
SMILESN#CCc1cc(F)c(NS(=O)(=O)c2cnc3cc(Cl)ccn23)cc1F
InChIInChI=1S/C15H9ClF2N4O2S/c16-10-2-4-22-14(6-10)20-8-15(22)25(23,24)21-13-7-11(17)9(1-3-19)5-12(13)18/h2,4-8,21H,1H2
InChIKeyPNPFHLXWFQBELE-UHFFFAOYSA-N
XLogP3.13
TPSA87.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.78
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide with MolForge

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Related Compounds

2-(6-chloro-4-fluoro-3-pyridinyl)acetonitrile
CID 119024596
N-[6-(2,2-difluoroethoxy)-5-fluoro-2-methoxy-3-pyridinyl]-7-(3-hydroxyoxetan-3-yl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 170733443
8-cyano-N-[6-(2,2-difluoroethoxy)-5-fluoro-2-methoxy-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine-3-sulfonamide
CID 170733496
7-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-2-methoxy-3-pyridinyl]imidazo[1,2-a]pyridine-3-sulfonamide
CID 170733407
7-bromo-N-(5-chloro-2-fluorophenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 178093219
N-(5-chloro-2-fluorophenyl)-2-cyanopyridine-3-sulfonamide
CID 106595617
7-chloro-3-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 117256482
N-(4,6-dimethoxy-5-methylpyrimidin-2-yl)-7-methylimidazo[1,2-a]pyridine-3-sulfonamide
CID 170733433
7-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 55265824
N-(5-chloro-2-fluorophenyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide
CID 106030354
2-(7-chloro-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 82529975
N-(5-amino-2-fluorophenyl)-4-(cyanomethyl)benzenesulfonamide
CID 79185246

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide (CID 170733486) is 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide is N#CCc1cc(F)c(NS(=O)(=O)c2cnc3cc(Cl)ccn23)cc1F.
What is the InChIKey of 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is PNPFHLXWFQBELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClF2N4O2S/c16-10-2-4-22-14(6-10)20-8-15(22)25(23,24)21-13-7-11(17)9(1-3-19)5-12(13)18/h2,4-8,21H,1H2.
What are the key properties of 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide?
7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 382.78 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-[4-(cyanomethyl)-2,5-difluorophenyl]imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 170733486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).