2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine

C10H9F3N2O2S — CID 170213646

IUPAC2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine
SMILESCc1nc2cc(S(=O)(=O)C(F)(F)F)ccn2c1C
InChIInChI=1S/C10H9F3N2O2S/c1-6-7(2)15-4-3-8(5-9(15)14-6)18(16,17)10(11,12)13/h3-5H,1-2H3
InChIKeyBOTBZQCFPFXHJY-UHFFFAOYSA-N
MW278.26 g/mol
LogP2.24
Rot. Bonds1

About 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine

2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine (PubChem CID 170213646) has the molecular formula C10H9F3N2O2S and a molecular weight of 278.26 g/mol. Its IUPAC name is 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine
PubChem CID170213646
Molecular FormulaC10H9F3N2O2S
Molecular Weight278.26 g/mol
Exact Mass278.03
IUPAC Name2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine
SMILESCc1nc2cc(S(=O)(=O)C(F)(F)F)ccn2c1C
InChIInChI=1S/C10H9F3N2O2S/c1-6-7(2)15-4-3-8(5-9(15)14-6)18(16,17)10(11,12)13/h3-5H,1-2H3
InChIKeyBOTBZQCFPFXHJY-UHFFFAOYSA-N
XLogP2.24
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.26
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine?
The IUPAC name of 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine (CID 170213646) is 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine is Cc1nc2cc(S(=O)(=O)C(F)(F)F)ccn2c1C.
What is the InChIKey of 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine?
The InChIKey is BOTBZQCFPFXHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O2S/c1-6-7(2)15-4-3-8(5-9(15)14-6)18(16,17)10(11,12)13/h3-5H,1-2H3.
What are the key properties of 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine?
2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine has a molecular weight of 278.26 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-7-(trifluoromethylsulfonyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 170213646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).