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

C10H9ClF3N3O2S — CID 63226997

IUPAC2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(NCCC(F)(F)F)c1c(Cl)nc2ccccn12
InChIInChI=1S/C10H9ClF3N3O2S/c11-8-9(17-6-2-1-3-7(17)16-8)20(18,19)15-5-4-10(12,13)14/h1-3,6,15H,4-5H2
InChIKeyAQHLUVPLQMEYIF-UHFFFAOYSA-N
MW327.72 g/mol
LogP2.22
Rot. Bonds4

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

2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 63226997) has the molecular formula C10H9ClF3N3O2S and a molecular weight of 327.72 g/mol. Its IUPAC name is 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID63226997
Molecular FormulaC10H9ClF3N3O2S
Molecular Weight327.72 g/mol
Exact Mass327.01
IUPAC Name2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESO=S(=O)(NCCC(F)(F)F)c1c(Cl)nc2ccccn12
InChIInChI=1S/C10H9ClF3N3O2S/c11-8-9(17-6-2-1-3-7(17)16-8)20(18,19)15-5-4-10(12,13)14/h1-3,6,15H,4-5H2
InChIKeyAQHLUVPLQMEYIF-UHFFFAOYSA-N
XLogP2.22
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.72
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 63226997) is 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide is O=S(=O)(NCCC(F)(F)F)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is AQHLUVPLQMEYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClF3N3O2S/c11-8-9(17-6-2-1-3-7(17)16-8)20(18,19)15-5-4-10(12,13)14/h1-3,6,15H,4-5H2.
What are the key properties of 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 327.72 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 63226997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).