7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride

C8H8ClF3N2O2S — CID 170733410

IUPAC7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cnc2n1CCC(C(F)(F)F)C2
InChIInChI=1S/C8H8ClF3N2O2S/c9-17(15,16)7-4-13-6-3-5(8(10,11)12)1-2-14(6)7/h4-5H,1-3H2
InChIKeyVORISTGQMUDTHJ-UHFFFAOYSA-N
MW288.68 g/mol
LogP1.94
Rot. Bonds1

About 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride

7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride (PubChem CID 170733410) has the molecular formula C8H8ClF3N2O2S and a molecular weight of 288.68 g/mol. Its IUPAC name is 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride
PubChem CID170733410
Molecular FormulaC8H8ClF3N2O2S
Molecular Weight288.68 g/mol
Exact Mass287.99
IUPAC Name7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cnc2n1CCC(C(F)(F)F)C2
InChIInChI=1S/C8H8ClF3N2O2S/c9-17(15,16)7-4-13-6-3-5(8(10,11)12)1-2-14(6)7/h4-5H,1-3H2
InChIKeyVORISTGQMUDTHJ-UHFFFAOYSA-N
XLogP1.94
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.68
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride?
The IUPAC name of 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride (CID 170733410) is 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride.
What is the SMILES notation for 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride?
The canonical SMILES for 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1cnc2n1CCC(C(F)(F)F)C2.
What is the InChIKey of 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride?
The InChIKey is VORISTGQMUDTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClF3N2O2S/c9-17(15,16)7-4-13-6-3-5(8(10,11)12)1-2-14(6)7/h4-5H,1-3H2.
What are the key properties of 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride?
7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride has a molecular weight of 288.68 g/mol, XLogP of 1.94, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-sulfonyl chloride is sourced from PubChem (CID 170733410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).