N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide

C13H17N3O3S — CID 51108649

IUPACN-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCCS(=O)(=O)CCNC(=O)c1cn2ccc(C)cc2n1
InChIInChI=1S/C13H17N3O3S/c1-3-20(18,19)7-5-14-13(17)11-9-16-6-4-10(2)8-12(16)15-11/h4,6,8-9H,3,5,7H2,1-2H3,(H,14,17)
InChIKeyNYVABQSTUPOOMW-UHFFFAOYSA-N
MW295.36 g/mol
LogP0.81
Rot. Bonds5

About N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide

N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 51108649) has the molecular formula C13H17N3O3S and a molecular weight of 295.36 g/mol. Its IUPAC name is N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID51108649
Molecular FormulaC13H17N3O3S
Molecular Weight295.36 g/mol
Exact Mass295.10
IUPAC NameN-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCCS(=O)(=O)CCNC(=O)c1cn2ccc(C)cc2n1
InChIInChI=1S/C13H17N3O3S/c1-3-20(18,19)7-5-14-13(17)11-9-16-6-4-10(2)8-12(16)15-11/h4,6,8-9H,3,5,7H2,1-2H3,(H,14,17)
InChIKeyNYVABQSTUPOOMW-UHFFFAOYSA-N
XLogP0.81
TPSA80.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-acetamidoethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 46684175
7-methyl-N-(2-piperidin-1-ylsulfonylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 46971998
N-(3-indol-1-ylpropyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 24512759
N-benzyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172225
7-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 46655437
N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 34674868
N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 94169651
7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 52530334
N-cycloheptyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 40723824
(2S,3S)-3-methyl-2-[(7-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]pentanoic acid
CID 119194403
N-[(4-hydroxypyrrolidin-3-yl)methyl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide;dihydrochloride
CID 120943217
N-[(3-ethoxyphenyl)methyl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 87051316

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 51108649) is N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide is CCS(=O)(=O)CCNC(=O)c1cn2ccc(C)cc2n1.
What is the InChIKey of N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is NYVABQSTUPOOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3S/c1-3-20(18,19)7-5-14-13(17)11-9-16-6-4-10(2)8-12(16)15-11/h4,6,8-9H,3,5,7H2,1-2H3,(H,14,17).
What are the key properties of N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 295.36 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylsulfonylethyl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 51108649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).