N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide

C15H12F3N3O2S — CID 162535328

IUPACN-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1cccc(-c2cn3cc(C(F)(F)F)ccc3n2)c1
InChIInChI=1S/C15H12F3N3O2S/c1-24(22,23)20-12-4-2-3-10(7-12)13-9-21-8-11(15(16,17)18)5-6-14(21)19-13/h2-9,20H,1H3
InChIKeyKWGIFHJZGGMPJU-UHFFFAOYSA-N
MW355.34 g/mol
LogP3.39
Rot. Bonds3

About N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide

N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide (PubChem CID 162535328) has the molecular formula C15H12F3N3O2S and a molecular weight of 355.34 g/mol. Its IUPAC name is N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide
PubChem CID162535328
Molecular FormulaC15H12F3N3O2S
Molecular Weight355.34 g/mol
Exact Mass355.06
IUPAC NameN-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1cccc(-c2cn3cc(C(F)(F)F)ccc3n2)c1
InChIInChI=1S/C15H12F3N3O2S/c1-24(22,23)20-12-4-2-3-10(7-12)13-9-21-8-11(15(16,17)18)5-6-14(21)19-13/h2-9,20H,1H3
InChIKeyKWGIFHJZGGMPJU-UHFFFAOYSA-N
XLogP3.39
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.34
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide?
The IUPAC name of N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide (CID 162535328) is N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide.
What is the SMILES notation for N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide?
The canonical SMILES for N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide is CS(=O)(=O)Nc1cccc(-c2cn3cc(C(F)(F)F)ccc3n2)c1.
What is the InChIKey of N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide?
The InChIKey is KWGIFHJZGGMPJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3N3O2S/c1-24(22,23)20-12-4-2-3-10(7-12)13-9-21-8-11(15(16,17)18)5-6-14(21)19-13/h2-9,20H,1H3.
What are the key properties of N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide?
N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide has a molecular weight of 355.34 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl]methanesulfonamide is sourced from PubChem (CID 162535328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).