2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide

C17H16F5N3OS — CID 126710536

IUPAC2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc2nc(C)c(C(=O)NCc3cccc(S(F)(F)(F)(F)F)c3)n2c1
InChIInChI=1S/C17H16F5N3OS/c1-11-6-7-15-24-12(2)16(25(15)10-11)17(26)23-9-13-4-3-5-14(8-13)27(18,19,20,21)22/h3-8,10H,9H2,1-2H3,(H,23,26)
InChIKeyLFVQLEPDPKRDFY-UHFFFAOYSA-N
MW405.39 g/mol
LogP5.54
Rot. Bonds4

About 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide

2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 126710536) has the molecular formula C17H16F5N3OS and a molecular weight of 405.39 g/mol. Its IUPAC name is 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID126710536
Molecular FormulaC17H16F5N3OS
Molecular Weight405.39 g/mol
Exact Mass405.09
IUPAC Name2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc2nc(C)c(C(=O)NCc3cccc(S(F)(F)(F)(F)F)c3)n2c1
InChIInChI=1S/C17H16F5N3OS/c1-11-6-7-15-24-12(2)16(25(15)10-11)17(26)23-9-13-4-3-5-14(8-13)27(18,19,20,21)22/h3-8,10H,9H2,1-2H3,(H,23,26)
InChIKeyLFVQLEPDPKRDFY-UHFFFAOYSA-N
XLogP5.54
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.39
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-dimethyl-N-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274322
2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 126710479
N-[(3-chlorophenyl)methyl]-6-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 71598223
2,6-dimethyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 50949765
6-bromo-2-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 134816766
2-ethyl-6-methyl-N-[(1-methylindol-6-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 53469011
7-ethyl-2-methyl-N-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 171356527
2-methyl-N-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 110704167
2-amino-1-(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 83832171
N-benzyl-2-hydroxy-7-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 136790825
N-[2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 50956911
2,7-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274552

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 126710536) is 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc2nc(C)c(C(=O)NCc3cccc(S(F)(F)(F)(F)F)c3)n2c1.
What is the InChIKey of 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LFVQLEPDPKRDFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F5N3OS/c1-11-6-7-15-24-12(2)16(25(15)10-11)17(26)23-9-13-4-3-5-14(8-13)27(18,19,20,21)22/h3-8,10H,9H2,1-2H3,(H,23,26).
What are the key properties of 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide?
2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 405.39 g/mol, XLogP of 5.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[[3-(pentafluoro-λ6-sulfanyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 126710536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).