3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide

C16H14F3N3O2S — CID 122284159

IUPAC3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide
SMILESO=S(=O)(CCC(F)(F)F)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C16H14F3N3O2S/c17-16(18,19)8-10-25(23,24)21-13-6-4-12(5-7-13)14-11-22-9-2-1-3-15(22)20-14/h1-7,9,11,21H,8,10H2
InChIKeyITQWXLQUUUJUMI-UHFFFAOYSA-N
MW369.37 g/mol
LogP3.70
Rot. Bonds5

About 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide

3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide (PubChem CID 122284159) has the molecular formula C16H14F3N3O2S and a molecular weight of 369.37 g/mol. Its IUPAC name is 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide.

Molecular Properties

Compound Name3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide
PubChem CID122284159
Molecular FormulaC16H14F3N3O2S
Molecular Weight369.37 g/mol
Exact Mass369.08
IUPAC Name3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide
SMILESO=S(=O)(CCC(F)(F)F)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C16H14F3N3O2S/c17-16(18,19)8-10-25(23,24)21-13-6-4-12(5-7-13)14-11-22-9-2-1-3-15(22)20-14/h1-7,9,11,21H,8,10H2
InChIKeyITQWXLQUUUJUMI-UHFFFAOYSA-N
XLogP3.70
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.37
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzenesulfonamide
CID 695162
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)cyclopropanesulfonamide
CID 122284124
2-chloro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzenesulfonamide
CID 122284029
2,4-difluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzenesulfonamide
CID 122284032
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-1-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 122283461
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3,4-dimethoxybenzenesulfonamide
CID 6494027
1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-[4-(trifluoromethoxy)phenyl]urea
CID 122284041
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 122284110
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)ethanesulfonamide
CID 23608319
4-fluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2H-tetrazol-5-yl)benzenesulfonamide
CID 122284170
4-ethoxy-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbenzenesulfonamide
CID 122284141
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 16717662

Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide?
The IUPAC name of 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide (CID 122284159) is 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide.
What is the SMILES notation for 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide?
The canonical SMILES for 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide is O=S(=O)(CCC(F)(F)F)Nc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide?
The InChIKey is ITQWXLQUUUJUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3N3O2S/c17-16(18,19)8-10-25(23,24)21-13-6-4-12(5-7-13)14-11-22-9-2-1-3-15(22)20-14/h1-7,9,11,21H,8,10H2.
What are the key properties of 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide?
3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide has a molecular weight of 369.37 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)propane-1-sulfonamide is sourced from PubChem (CID 122284159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).