2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide

C11H11ClF3N3O2S — CID 61060335

IUPAC2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCN(CC(F)(F)F)S(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C11H11ClF3N3O2S/c1-2-17(7-11(13,14)15)21(19,20)10-9(12)16-8-5-3-4-6-18(8)10/h3-6H,2,7H2,1H3
InChIKeyLBAZQOSIDOLRNX-UHFFFAOYSA-N
MW341.74 g/mol
LogP2.56
Rot. Bonds4

About 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 61060335) has the molecular formula C11H11ClF3N3O2S and a molecular weight of 341.74 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID61060335
Molecular FormulaC11H11ClF3N3O2S
Molecular Weight341.74 g/mol
Exact Mass341.02
IUPAC Name2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCN(CC(F)(F)F)S(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C11H11ClF3N3O2S/c1-2-17(7-11(13,14)15)21(19,20)10-9(12)16-8-5-3-4-6-18(8)10/h3-6H,2,7H2,1H3
InChIKeyLBAZQOSIDOLRNX-UHFFFAOYSA-N
XLogP2.56
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.74
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 61060335) is 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide is CCN(CC(F)(F)F)S(=O)(=O)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is LBAZQOSIDOLRNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClF3N3O2S/c1-2-17(7-11(13,14)15)21(19,20)10-9(12)16-8-5-3-4-6-18(8)10/h3-6H,2,7H2,1H3.
What are the key properties of 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 341.74 g/mol, XLogP of 2.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 61060335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).